Protein dynamics from nuclear magnetic relaxation.
Charlier, Cyril; Cousin, Samuel F; Ferrage, Fabien
2016-05-01
Nuclear magnetic resonance is a ubiquitous spectroscopic tool to explore molecules with atomic resolution. Nuclear magnetic relaxation is intimately connected to molecular motions. Many methods and models have been developed to measure and interpret the characteristic rates of nuclear magnetic relaxation in proteins. These approaches shed light on a rich and diverse range of motions covering timescales from picoseconds to seconds. Here, we introduce some of the basic concepts upon which these approaches are built and provide a series of illustrations.
Nicolas Garraud
2017-05-01
Full Text Available The design and validation of a magnetic particle spectrometer (MPS system used to study the linear and nonlinear behavior of magnetic nanoparticle suspensions is presented. The MPS characterizes the suspension dynamic response, both due to relaxation and saturation effects, which depends on the magnetic particles and their environment. The system applies sinusoidal excitation magnetic fields varying in amplitude and frequency and can be configured for linear measurements (1 mT at up to 120 kHz and nonlinear measurements (50 mT at up to 24 kHz. Time-resolved data acquisition at up to 4 MS/s combined with hardware and software-based signal processing allows for wide-band measurements up to 50 harmonics in nonlinear mode. By cross-calibrating the instrument with a known sample, the instantaneous sample magnetization can be quantitatively reconstructed. Validation of the two MPS modes are performed for iron oxide and cobalt ferrite suspensions, exhibiting Néel and Brownian relaxation, respectively.
Maldonado-Camargo, L. [Department of Chemical Engineering, University of Florida, Gainesville, FL 32611 (United States); Torres-Díaz, I. [J. Crayton Pruitt Family Department of Biomedical Engineering, University of Florida, Gainesville, FL 32611 (United States); Chiu-Lam, A. [Department of Chemical Engineering, University of Florida, Gainesville, FL 32611 (United States); Hernández, M. [J. Crayton Pruitt Family Department of Biomedical Engineering, University of Florida, Gainesville, FL 32611 (United States); Rinaldi, C., E-mail: carlos.rinaldi@bme.ufl.edu [Department of Chemical Engineering, University of Florida, Gainesville, FL 32611 (United States); J. Crayton Pruitt Family Department of Biomedical Engineering, University of Florida, Gainesville, FL 32611 (United States)
2016-08-15
We demonstrate how dynamic magnetic susceptibility measurements (DMS) can be used to estimate the relative contributions of Brownian and Néel relaxation to the dynamic magnetic response of a magnetic fluid, a suspension of magnetic nanoparticles. The method applies to suspensions with particles that respond through Brownian or Néel relaxation and for which the characteristic Brownian and Néel relaxation times are widely separated. First, we illustrate this using magnetic fluids consisting of mixtures of particles that relax solely by the Brownian or Néel mechanisms. Then, it is shown how the same approach can be applied to estimate the relative contributions of Brownian and Néel relaxation in a suspension consisting of particles obtained from a single synthesis and whose size distribution straddles the transition from Néel to Brownian relaxation. - Highlights: • Method to estimate the contributions of the relaxation mechanism to the magnetic response. • Method applies to cases where the Brownian and Néel peaks do not overlap. • The method applies for ferrofluids prepared with as–synthesized particles.
Panczyk, Tomasz; Konczak, Lukasz; Zapotoczny, Szczepan; Szabelski, Pawel; Nowakowska, Maria
2015-01-01
In this work we have analyzed the influence of various factors on the transverse relaxation times T2 of water protons in suspension of magnetic nanoparticles. For that purpose we developed a full molecular dynamics force field which includes the effects of dispersion interactions between magnetic nanoparticles and water molecules, electrostatic interactions between charged nanoparticles and magnetic dipole-dipole and dipole-external field interactions. We also accounted for the magnetization reversal within the nanoparticles body frames due to finite magnetic anisotropy barriers. The force field together with the Langevin dynamics imposed on water molecules and the nanoparticles allowed us to monitor the dephasing of water protons in real time. Thus, we were able to determine the T2 relaxation times including the effects of the adsorption of water on the nanoparticles' surfaces, thermal fluctuations of the orientation of nanoparticles' magnetizations as well as the effects of the core-shell architecture of nanoparticles and their agglomeration into clusters. We found that there exists an optimal cluster size for which T2 is minimized and that the retardation of water molecules motion, due to adsorption on the nanoparticles surfaces, has some effect in the measured T2 times. The typical strengths of the external magnetic fields in MRI are enough to keep the magnetizations fixed along the field direction, however, in the case of low magnetic fields, we observed significant enhancement of T2 due to thermal fluctuations of the orientations of magnetizations. Copyright © 2014 Elsevier Inc. All rights reserved.
Folk, R; Holovatch, Yu; Moser, G
2009-03-01
We calculate the relaxational dynamical critical behavior of systems of O(n_{ parallel}) plus sign in circleO(n_{ perpendicular}) symmetry including conservation of magnetization by renormalization group theory within the minimal subtraction scheme in two-loop order. Within the stability region of the Heisenberg fixed point and the biconical fixed point, strong dynamical scaling holds, with the asymptotic dynamical critical exponent z=2varphinu-1 , where varphi is the crossover exponent and nu the exponent of the correlation length. The critical dynamics at n_{ parallel}=1 and n_{ perpendicular}=2 is governed by a small dynamical transient exponent leading to nonuniversal nonasymptotic dynamical behavior. This may be seen, e.g., in the temperature dependence of the magnetic transport coefficients.
Mischenko, I.; Chuev, M.
2016-12-01
Principal difference of magnetic nanoparticles from the bulk matter which cannot be ignored when constructing upon them combined metamaterials and modern devices is the essential influence on their behavior thermal fluctuations of the environment. These disturbances lead to specific distributions of the particles characteristics and to stochastic reorientations of their magnetic moments. On the basis of quantum-mechanical representation of the particle possessing intrinsic magnetic anisotropy and being placed onto the external magnetic field we developed general approach to describe equilibrium magnetization curves and relaxation Mössbauer spectra of magnetic nanoparticles for diagnostics of magnetic nanomaterials in the whole temperature or external field ranges. This approach has universal character and may be applied not only to the systems under thermal equilibrium, but may in principle describe macroscopic dynamical phenomena such as magnetization reversal.
Ultrafast photo-induced turning of magnetization and its relaxation dynamics in GaMnAs
无
2010-01-01
We report that,by linearly polarized pumping of different wavelengths,Kerr transients appear at zero magnetic field only in the case when GaMnAs samples are initialized at 3 K by first applying a 0.8 Tesla field and then returning to zero field.We find that,instead of magnetization precession,the near-band gap excitation induces a coherent out-of-plane turning of magnetization,which shows very long relaxation dynamics with no precession.When photon energy increases,the peak value of the Kerr transient increases,but it decays rapidly to the original slow transient seen under the near-band-gap excitation.
Dynamical Relaxation of Coronal Magnetic Fields. III. 3D Spiral Nulls
Fuentes-Fernandez, Jorge
2012-01-01
Context: The majority of studies on stressed 3D magnetic null points consider magnetic reconnection driven by an external perturbation, but the formation of a genuine current sheet equilibrium remains poorly understood. This problem has been considered more extensively in two-dimensions, but lacks a generalization into 3D fields. Aims: 3D magnetic nulls are more complex than 2D nulls and the field can take a greater range of magnetic geometries local to the null. Here, we focus on one type and consider the dynamical non-resistive relaxation of 3D spiral nulls with initial spine-aligned current. We aim to provide a valid magnetohydrostatic equilibrium, and describe the electric current accumulations in various cases, involving a finite plasma pressure. Methods: A full MHD code is used, with the resistivity set to zero so that reconnection is not allowed, to run a series of experiments in which a perturbed spiral 3D null point is allowed to relax towards an equilibrium, via real, viscous damping forces. Changes...
Magnetohydrodynamics dynamical relaxation of coronal magnetic fields. III. 3D spiral nulls
Fuentes-Fernández, J.; Parnell, C. E.
2012-08-01
Context. The majority of studies on stressed 3D magnetic null points consider magnetic reconnection driven by an external perturbation, but the formation of a genuine current sheet equilibrium remains poorly understood. This problem has been considered more extensively in two dimensions, but lacks a generalization into 3D fields. Aims: 3D magnetic nulls are more complex than 2D nulls and the field can take a greater range of magnetic geometries local to the null. Here, we focus on one type and consider the dynamical non-resistive relaxation of 3D spiral nulls with initial spine-aligned current. We aim to provide a valid magnetohydrostatic equilibrium, and describe the electric current accumulations in various cases, involving a finite plasma pressure. Methods: A full MHD code was used, with the resistivity set to zero so that reconnection is not allowed, to run a series of experiments in which a perturbed spiral 3D null point was allowed to relax towards an equilibrium via real, viscous damping forces. Changes to the initial plasma pressure and other magnetic parameters were systematically investigated. Results: For the axisymmetric case, the evolution of the field and the plasma is such that it concentrates the current density into two cone-shaped regions along the spine, thus concentrating the twist of the magnetic field around the spine, leaving a radial configuration in the fan plane. The plasma pressure redistributes to maintain the current density accumulations. However, it is found that changes in the initial plasma pressure do not significantly modify the final state. In the cases where the initial magnetic field is not axisymmetric, an infinite-time singularity of current perpendicular to the fan is found at the location of the null.
Kirtil, Emrah; Dag, Damla; Guner, Selen; Unal, Kubra; Oztop, Mecit H
2017-09-01
Liposomes are lipid bilayer vesicles that can be used as encapsulation systems for bioactive agents to provide increased protection against environmental stresses (such as pH or temperature extremes). Time Domain Nuclear Magnetic Resonance (TD-NMR) that is based on differentiation of specimen contents with respect to magnetic relaxation rates provides detailed information on amount, state and distribution of water and oil and provide reproducible results on the samples. These make TD-NMR particularly suitable for time-dependent monitoring of emulsion system dynamics. In this study, spin-spin (T2) relaxation times and relaxation spectra were used for characterizing green tea extract loaded and unloaded liposomes prepared with soy (S75) and egg lecithins (E80) by different preparation methods (such as homogenization type, pressure and solvent type). Mean particle sizes of liposomes were found to be the most influential factor in shaping mono-exponential T2 relaxation times. The differences in particle sizes of E80 and S75 samples along with samples with different homogenization pressures could be monitored with T2 relaxation times. Additionally, T2 relaxation times were found to be correlated with particle shape irregularity, and chemical instability of samples due to lipid oxidation. With relaxation spectrum analysis, particular components in the sample could be distinguished (internal/external water and lipid bilayers), which gave more elaborate results on mechanisms of instability. Copyright © 2017 Elsevier Ltd. All rights reserved.
Luchinat, Claudio; Parigi, Giacomo
2007-02-07
Since the recent availability of high sensitivity field-cycling relaxometers, it has become possible to measure the protein proton relaxation in millimolar protein solutions as a function of magnetic field. In principle, this provides direct access to the so-called spectral density function of protein protons and, hence, to a full set of dynamic parameters. Understanding the dynamic behavior of biological molecules is increasingly appreciated as crucial to understanding their function. However, theoretical tools to analyze the collective relaxation behavior of protons in solute macromolecules over a wide range of magnetic fields are lacking. A complete relaxation matrix analysis of such behavior is described here. This analysis provides excellent predictions of the experimental proton magnetization decays/recoveries-measured to an unprecedented level of accuracy by a last-generation fast field-cycling relaxometer-of two different globular proteins, hen egg white lysozyme and human serum albumin. The new experimentally validated theoretical model is then used to extract dynamic information on these systems. A "collective" order parameter SC2, different from, but complementary to, that commonly extracted from heteronuclear relaxation measurements at high field, is defined and measured. An accurate estimate of the rotational correlation time is obtained: in the case of lysozyme it agrees very well with theoretical predictions; in the case of serum albumin it provides evidence for aggregation at millimolar concentration.
Negative magnetic relaxation in superconductors
Krasnoperov E.P.
2013-01-01
Full Text Available It was observed that the trapped magnetic moment of HTS tablets or annuli increases in time (negative relaxation if they are not completely magnetized by a pulsed magnetic field. It is shown, in the framework of the Bean critical-state model, that the radial temperature gradient appearing in tablets or annuli during a pulsed field magnetization can explain the negative magnetic relaxation in the superconductor.
Magnetic relaxation dynamics driven by the first-order character of magnetocaloric La(Fe,Mn,Si)13.
Lovell, Edmund; Bratko, Milan; Caplin, A David; Barcza, Alexander; Katter, Matthias; Ghivelder, Luis; Cohen, Lesley F
2016-08-13
Here, we study the temporal evolution of the magnetic field-driven paramagnetic to ferromagnetic transition in the La(Fe,Mn,Si)13 material family. Three compositions are chosen that show varying strengths of the first-order character of the transition, as determined by the relative magnitude of their magnetic hysteresis and temperature separation between the zero-field transition temperature Tc and the temperature Tcrit, where the transition becomes continuous. Systematic variations in the fixed field, isothermal rate of relaxation are observed as a function of temperature and as a function of the degree of first-order character. The relaxation rate is reduced in more weakly first-order compositions and is also reduced as the temperature is increased towards Tcrit At temperatures above Tcrit, the metastability of the transition vanishes along with its associated temporal dynamics.This article is part of the themed issue 'Taking the temperature of phase transitions in cool materials'.
Magnetic relaxation in anisotropic magnets
Lindgård, Per-Anker
1971-01-01
The line shape and the kinematic and thermodynamic slowing down of the critical and paramagnetic relaxation in axially anisotropic materials are discussed. Kinematic slowing down occurs only in the longitudinal relaxation function. The thermodynamic slowing down occurs in either the transverse or...
Toyama, Yuki; Kano, Hanaho; Mase, Yoko; Yokogawa, Mariko; Osawa, Masanori; Shimada, Ichio
2017-02-22
Heterotrimeric guanine-nucleotide-binding proteins (G proteins) serve as molecular switches in signalling pathways, by coupling the activation of cell surface receptors to intracellular responses. Mutations in the G protein α-subunit (Gα) that accelerate guanosine diphosphate (GDP) dissociation cause hyperactivation of the downstream effector proteins, leading to oncogenesis. However, the structural mechanism of the accelerated GDP dissociation has remained unclear. Here, we use magnetic field-dependent nuclear magnetic resonance relaxation analyses to investigate the structural and dynamic properties of GDP bound Gα on a microsecond timescale. We show that Gα rapidly exchanges between a ground-state conformation, which tightly binds to GDP and an excited conformation with reduced GDP affinity. The oncogenic D150N mutation accelerates GDP dissociation by shifting the equilibrium towards the excited conformation.
Toyama, Yuki; Kano, Hanaho; Mase, Yoko; Yokogawa, Mariko; Osawa, Masanori; Shimada, Ichio
2017-01-01
Heterotrimeric guanine-nucleotide-binding proteins (G proteins) serve as molecular switches in signalling pathways, by coupling the activation of cell surface receptors to intracellular responses. Mutations in the G protein α-subunit (Gα) that accelerate guanosine diphosphate (GDP) dissociation cause hyperactivation of the downstream effector proteins, leading to oncogenesis. However, the structural mechanism of the accelerated GDP dissociation has remained unclear. Here, we use magnetic field-dependent nuclear magnetic resonance relaxation analyses to investigate the structural and dynamic properties of GDP bound Gα on a microsecond timescale. We show that Gα rapidly exchanges between a ground-state conformation, which tightly binds to GDP and an excited conformation with reduced GDP affinity. The oncogenic D150N mutation accelerates GDP dissociation by shifting the equilibrium towards the excited conformation. PMID:28223697
Ota, Satoshi; Kitaguchi, Ryoichi; Takeda, Ryoji; Yamada, Tsutomu; Takemura, Yasushi
2016-09-10
The dependence of magnetic relaxation on particle parameters, such as the size and anisotropy, has been conventionally discussed. In addition, the influences of external conditions, such as the intensity and frequency of the applied field, the surrounding viscosity, and the temperature on the magnetic relaxation have been researched. According to one of the basic theories regarding magnetic relaxation, the faster type of relaxation dominates the process. However, in this study, we reveal that Brownian and Néel relaxations coexist and that Brownian relaxation can occur after Néel relaxation despite having a longer relaxation time. To understand the mechanisms of Brownian rotation, alternating current (AC) hysteresis loops were measured in magnetic fluids of different viscosities. These loops conveyed the amplitude and phase delay of the magnetization. In addition, the intrinsic loss power (ILP) was calculated using the area of the AC hysteresis loops. The ILP also showed the magnetization response regarding the magnetic relaxation over a wide frequency range. To develop biomedical applications of magnetic nanoparticles, such as hyperthermia and magnetic particle imaging, it is necessary to understand the mechanisms of magnetic relaxation.
Satoshi Ota
2016-09-01
Full Text Available The dependence of magnetic relaxation on particle parameters, such as the size and anisotropy, has been conventionally discussed. In addition, the influences of external conditions, such as the intensity and frequency of the applied field, the surrounding viscosity, and the temperature on the magnetic relaxation have been researched. According to one of the basic theories regarding magnetic relaxation, the faster type of relaxation dominates the process. However, in this study, we reveal that Brownian and Néel relaxations coexist and that Brownian relaxation can occur after Néel relaxation despite having a longer relaxation time. To understand the mechanisms of Brownian rotation, alternating current (AC hysteresis loops were measured in magnetic fluids of different viscosities. These loops conveyed the amplitude and phase delay of the magnetization. In addition, the intrinsic loss power (ILP was calculated using the area of the AC hysteresis loops. The ILP also showed the magnetization response regarding the magnetic relaxation over a wide frequency range. To develop biomedical applications of magnetic nanoparticles, such as hyperthermia and magnetic particle imaging, it is necessary to understand the mechanisms of magnetic relaxation.
Magnetohydrodynamics dynamical relaxation of coronal magnetic fields. IV. 3D tilted nulls
Fuentes-Fernandez, Jorge
2013-01-01
In this paper we study current accumulations in 3D "tilted" nulls formed by a folding of the spine and fan. A non-zero component of current parallel to the fan is required such that the null's fan plane and spine are not perpendicular. Our aims are to provide valid magnetohydrostatic equilibria and to describe the current accumulations in various cases involving finite plasma pressure.To create our equilibrium current structures we use a full, non-resistive, magnetohydrodynamic (MHD) code so that no reconnection is allowed. A series of experiments are performed in which a perturbed 3D tilted null relaxes towards an equilibrium via real, viscous damping forces. Changes to the initial plasma pressure and to magnetic parameters are investigated systematically.An initially tilted fan is associated with a non-zero Lorentz force that drives the fan and spine to collapse towards each other, in a similar manner to the collapse of a 2D X-point. In the final equilibrium state for an initially radial null with only the ...
Ekomasov, E. G.
2003-08-01
The influence of exchange relaxation on the dynamics of domain walls with a "fine structure" in rare-earth orthoferrites in the presence of external magnetic and electric fields is investigated. A system of differential equations is obtained which describe the dynamics of a domain wall with a solitary line. The dependence of the steady-state velocity of the domain wall and line on the values of the relaxation parameters and on the components of the magnetic and electric fields is found. The results are compared with the known experimental results.
Magnetohydrodynamics dynamical relaxation of coronal magnetic fields. IV. 3D tilted nulls
Fuentes-Fernández, J.; Parnell, C. E.
2013-06-01
Context. There are various types of reconnection that may take place at 3D magnetic null points. Each different reconnection scenario must be associated with a particular type of current layer. Aims: A range of current layers may form because the topology of 3D nulls permits currents to form by either twisting the field about the spine of the null or by folding the fan and spine into each other. Additionally, the initial geometry of the field can lead to variations in the currents that are accumulated. Here, we study current accumulations in so-called 3D "tilted" nulls formed by a folding of the spine and fan. A non-zero component of current parallel to the fan is required such that the null's fan plane and spine are not perpendicular. Our aims are to provide valid magnetohydrostatic equilibria and to describe the current accumulations in various cases involving finite plasma pressure. Methods: To create our equilibrium current structures we use a full, non-resistive, magnetohydrodynamic (MHD) code so that no reconnection is allowed. A series of experiments are performed in which a perturbed 3D tilted null relaxes towards an equilibrium via real, viscous damping forces. Changes to the initial plasma pressure and to magnetic parameters are investigated systematically. Results: An initially tilted fan is associated with a non-zero Lorentz force that drives the fan and spine to collapse towards each other, in a similar manner to the collapse of a 2D X-point. In the final equilibrium state for an initially radial null with only the current perpendicular to the spine, the current concentrates along the tilt axis of the fan and in a layer about the null point with a sharp peak at the null itself. The continued growth of this peak indicates that the system is in an asymptotic regime involving an infinite time singularity at the null. When the initial tilt disturbance (current perpendicular to the spine) is combined with a spiral-type disturbance (current parallel to the
Plasma Relaxation Dynamics Moderated by Current Sheets
Dewar, Robert; Bhattacharjee, Amitava; Yoshida, Zensho
2014-10-01
Ideal magnetohydrodynamics (IMHD) is strongly constrained by an infinite number of microscopic constraints expressing mass, entropy and magnetic flux conservation in each infinitesimal fluid element, the latter preventing magnetic reconnection. By contrast, in the Taylor-relaxed equilibrium model all these constraints are relaxed save for global magnetic flux and helicity. A Lagrangian is presented that leads to a new variational formulation of magnetized fluid dynamics, relaxed MHD (RxMHD), all static solutions of which are Taylor equilibrium states. By postulating that some long-lived macroscopic current sheets can act as barriers to relaxation, separating the plasma into multiple relaxation regions, a further generalization, multi-relaxed MHD (MRxMHD), is developed. These concepts are illustrated using a simple two-region slab model similar to that proposed by Hahm and Kulsrud--the formation of an initial shielding current sheet after perturbation by boundary rippling is calculated using MRxMHD and the final island state, after the current sheet has relaxed through a reconnection sequence, is calculated using RxMHD. Australian Research Council Grant DP110102881.
YANG Yanwu; WANG Dehua; QIU Jianqing; QIAN Baogong; WANG Hongzuo
1992-01-01
The carbon-13 spin-spin relaxation times of fluorine-containing ionomers are measured and motional correlation times τ0 and τd are calculated by using VJGM model. The results show that the motions of polymer main chain in ionomers become more difficult with increasing of ionization degree and contents of functional group, and depend on the fine structures and stability of ionic microdomains.
Dynamical theory of spin relaxation
Field, Timothy R.; Bain, Alex D.
2013-02-01
The dynamics of a spin system is usually calculated using the density matrix. However, the usual formulation in terms of the density matrix predicts that the signal will decay to zero, and does not address the issue of individual spin dynamics. Using stochastic calculus, we develop a dynamical theory of spin relaxation, the origins of which lie in the component spin fluctuations. This entails consideration of random pure states for individual protons, and how these pure states are correctly combined when the density matrix is formulated. Both the lattice and the spins are treated quantum mechanically. Such treatment incorporates both the processes of spin-spin and (finite temperature) spin-lattice relaxation. Our results reveal the intimate connections between spin noise and conventional spin relaxation.
Ultrafast magnetization dynamics
Woodford, S.
2008-01-01
This thesis addresses ultrafast magnetization dynamics from a theoretical perspective. The manipulation of magnetization using the inverse Faraday effect has been studied, as well as magnetic relaxation processes in quantum dots. The inverse Faraday effect – the generation of a magnetic field by nonresonant, circularly polarized light – offers the possibility to control and reverse magnetization on a timescale of a few hundred femtoseconds. This is important both for the technological advant...
Ultrafast Magnetization Dynamics
Woodford, S.
2008-01-01
This thesis addresses ultrafast magnetization dynamics from a theoretical perspective. The manipulation of magnetization using the inverse Faraday effect has been studied, as well as magnetic relaxation processes in quantum dots. The inverse Faraday effect – the generation of a magnetic field by nonresonant, circularly polarized light – offers the possibility to control and reverse magnetization on a timescale of a few hundred femtoseconds. This is important both for the technological advant...
Braided magnetic fields: equilibria, relaxation and heating
Pontin, D I; Russell, A J B; Hornig, G
2015-01-01
We examine the dynamics of magnetic flux tubes containing non-trivial field line braiding (or linkage), using mathematical and computational modelling. The key results obtained from recent modelling efforts are summarised, in the context of testable predictions for the laboratory. We discuss the existence of braided force-free equilibria, and demonstrate that for a field anchored at perfectly-conducting plates, these equilibria exist and contain current sheets whose thickness scales inversely with the braid complexity - as measured for example by the topological entropy. By contrast, for a periodic domain braided exact equilibria typically do not exist, while approximate equilibria contain thin current sheets. In the presence of resistivity, reconnection is triggered at the current sheets and a turbulent relaxation ensues. We discuss the properties of this relaxation, and in particular the existence of constraints that may mean that the final state is not the linear force-free field predicted by Taylor's hypo...
Dipolar relaxation of cold sodium atoms in a magnetic field
Zygelman, B
2002-01-01
A quantum mechanical close coupling theory of spin relaxation in the stretched hyperfine level of sodium is presented. We calculate the dipolar relaxation rate of magnetically trapped cold sodium atoms in the magnetic field. The influence of shape resonances and the anisotropy of the dipolar interaction on the collision dynamics are explored. We examine the sensitivity of the calculated cross sections on the choice of asymptotic atomic state basis.
Extended MHD Modeling of Tearing-Driven Magnetic Relaxation
Sauppe, Joshua
2016-10-01
Driven plasma pinch configurations are characterized by the gradual accumulation and episodic release of free energy in discrete relaxation events. The hallmark of this relaxation in a reversed-field pinch (RFP) plasma is flattening of the parallel current density profile effected by a fluctuation-induced dynamo emf in Ohm's law. Nonlinear two-fluid modeling of macroscopic RFP dynamics has shown appreciable coupling of magnetic relaxation and the evolution of plasma flow. Accurate modeling of RFP dynamics requires the Hall effect in Ohm's law as well as first order ion finite Larmor radius (FLR) effects, represented by the Braginskii ion gyroviscous stress tensor. New results find that the Hall dynamo effect from / ne can counter the MHD effect from - in some of the relaxation events. The MHD effect dominates these events and relaxes the current profile toward the Taylor state, but the opposition of the two dynamos generates plasma flow in the direction of equilibrium current density, consistent with experimental measurements. Detailed experimental measurements of the MHD and Hall emf terms are compared to these extended MHD predictions. Tracking the evolution of magnetic energy, helicity, and hybrid helicity during relaxation identifies the most important contributions in single-fluid and two-fluid models. Magnetic helicity is well conserved relative to the magnetic energy during relaxation. The hybrid helicity is dominated by magnetic helicity in realistic low-beta pinch conditions and is also well conserved. Differences of less than 1 % between magnetic helicity and hybrid helicity are observed with two-fluid modeling and result from cross helicity evolution through ion FLR effects, which have not been included in contemporary relaxation theories. The kinetic energy driven by relaxation in the computations is dominated by velocity components perpendicular to the magnetic field, an effect that had not been predicted. Work performed at University of Wisconsin
Thermally induced magnetic relaxation in square artificial spin ice
Andersson, M. S.; Pappas, S. D.; Stopfel, H.; Östman, E.; Stein, A.; Nordblad, P.; Mathieu, R.; Hjörvarsson, B.; Kapaklis, V.
2016-11-01
The properties of natural and artificial assemblies of interacting elements, ranging from Quarks to Galaxies, are at the heart of Physics. The collective response and dynamics of such assemblies are dictated by the intrinsic dynamical properties of the building blocks, the nature of their interactions and topological constraints. Here we report on the relaxation dynamics of the magnetization of artificial assemblies of mesoscopic spins. In our model nano-magnetic system - square artificial spin ice – we are able to control the geometrical arrangement and interaction strength between the magnetically interacting building blocks by means of nano-lithography. Using time resolved magnetometry we show that the relaxation process can be described using the Kohlrausch law and that the extracted temperature dependent relaxation times of the assemblies follow the Vogel-Fulcher law. The results provide insight into the relaxation dynamics of mesoscopic nano-magnetic model systems, with adjustable energy and time scales, and demonstrates that these can serve as an ideal playground for the studies of collective dynamics and relaxations.
Thermally induced magnetic relaxation in square artificial spin ice.
Andersson, M S; Pappas, S D; Stopfel, H; Östman, E; Stein, A; Nordblad, P; Mathieu, R; Hjörvarsson, B; Kapaklis, V
2016-11-24
The properties of natural and artificial assemblies of interacting elements, ranging from Quarks to Galaxies, are at the heart of Physics. The collective response and dynamics of such assemblies are dictated by the intrinsic dynamical properties of the building blocks, the nature of their interactions and topological constraints. Here we report on the relaxation dynamics of the magnetization of artificial assemblies of mesoscopic spins. In our model nano-magnetic system - square artificial spin ice - we are able to control the geometrical arrangement and interaction strength between the magnetically interacting building blocks by means of nano-lithography. Using time resolved magnetometry we show that the relaxation process can be described using the Kohlrausch law and that the extracted temperature dependent relaxation times of the assemblies follow the Vogel-Fulcher law. The results provide insight into the relaxation dynamics of mesoscopic nano-magnetic model systems, with adjustable energy and time scales, and demonstrates that these can serve as an ideal playground for the studies of collective dynamics and relaxations.
Magnetization Transfer Induced Biexponential Longitudinal Relaxation
Prantner, Andrew M.; Bretthorst, G. Larry; Neil, Jeffrey J.; Garbow, Joel R.; Ackerman, Joseph J.H.
2009-01-01
Longitudinal relaxation of brain water 1H magnetization in mammalian brain in vivo is typically analyzed on a per voxel basis using a monoexponential model, thereby assigning a single relaxation time constant to all 1H magnetization within a given voxel. This approach was tested by obtaining inversion recovery data from grey matter of rats at 64 exponentially-spaced recovery times. Using Bayesian probability for model selection, brain water data were best represented by a biexponential function characterized by fast and slow relaxation components. At 4.7 T, the amplitude fraction of the rapidly relaxing component is 3.4 ± 0.7 % with a rate constant of 44 ± 12 s-1 (mean ± SD; 174 voxels from 4 rats). The rate constant of the slow relaxing component is 0.66 ± 0.04 s-1. At 11.7 T, the corresponding values are 6.9 ± 0.9 %, 19 ± 5 s-1, and 0.48 ± 0.02 s-1 (151 voxels from 4 rats). Several putative mechanisms for biexponential relaxation behavior were evaluated, and magnetization transfer between bulk water protons and non-aqueous protons was determined to be the source of biexponential longitudinal relaxation. MR methods requiring accurate quantification of longitudinal relaxation may need to take this effect explicitly into account. PMID:18759367
Magnetic relaxation in a suspension of antiferromagnetic nanoparticles
Raikher, Yu. L.; Stepanov, V. I.
2008-09-01
A kinetic model is proposed to describe the low-frequency magnetodynamics of antiferromagnetic nanoparticles suspended in a fluid. Because of their small size, apart from an anisotropic magnetic susceptibility typical of antiferromagnets, these particles also have a constant magnetic moment caused by sublattice decompensation. An orientational crossover takes place in such a nanosuspension (colloid) when magnetized by a constant field: the axes of easy particle magnetization that were initially aligned along the field become oriented perpendicularly. This effect changes significantly the characteristics of the system’s magnetic response: the dynamic susceptibility spectrum and the relaxation time in a pulsed field.
Tunable finite-sized chains to control magnetic relaxation
Ekstrand, Paul D.; Javier, Daniel J.; Gredig, Thomas
2017-01-01
The magnetic dynamics of low-dimensional iron ion chains have been studied with regards to the tunable finite-sized chain length using iron phthalocyanine thin films. The deposition temperature varies the diffusion length during thin-film growth by limiting the average crystal size in the range from 40 to 110 nm . Using a method common for single chain magnets, the magnetic relaxation time for each chain length is determined from temporal remanence data and fit to a stretched exponential form in the temperature range below 5 K , the onset for magnetic hysteresis. A temperature-independent master curve is generated by scaling the remanence by its relaxation time to fit the energy barrier for spin reversal, and the single spin-relaxation time. The energy barrier of 95 K is found to be independent of the chain length. In contrast, the single spin-relaxation time increases with longer chains from under 1 ps to 800 ps. We show that thin films provide the nanoarchitecture to control magnetic relaxation and a testbed to study finite-size effects in low-dimensional magnetic systems.
Bartoš, J.; Šauša, O.; Schwartz, G. A.; Alegría, A.; Alberdi, J. M.; Arbe, A.; Krištiak, J.; Colmenero, J.
2011-04-01
We report a joint analysis of positron annihilation lifetime spectroscopy (PALS), dielectric spectroscopy (BDS), and nuclear magnetic resonance (NMR) on cis-trans-1,4-poly(butadiene) (c-t-1,4-PBD). Phenomenological analysis of the orthopositronium lifetime τ3 - T dependence by linear fitting reveals four characteristic PALS temperatures: T_{b1} ^G = 0{.63}T_g^{PALS}, T_g^{PALS}, T_{b1} ^L = 1.22T_g^{PALS}, and T_{b2} ^L = 1.52T_g^{PALS}. Slight bend effects in the glassy and supercooled liquid states are related to the fast or slow secondary β process, from neutron scattering, respectively, the latter being connected with the trans-isomers. In addition, the first bend effect in the supercooled liquid coincides with a deviation of the slow effective secondary βeff relaxation related to the cis-isomers from low-T Arrhenius behavior to non-Arrhenius one and correlates with the onset of the primary α process from BDS. The second plateau effect in the liquid state occurs when τ3 becomes commensurable with the structural relaxation time τα(Tb2). It is also approximately related to its crossover from non-Arrhenius to Arrhenius regime in the combined BDS and NMR data. Finally, the combined BDS and NMR structural relaxation data, when analyzed in terms of the two-order parameter (TOP) model, suggest the influence of solidlike domains on both the annihilation behavior and the local and segmental chain mobility in the supercooled liquid. All these findings indicate the influence of the dynamic heterogeneity in both the primary and secondary relaxations due to the cis-trans isomerism in c-t-1,4-PBD and their impact into the PALS response.
Effects of interactions on the relaxation processes in magnetic nanostructures
Atkinson, Lewis J.; Ostler, Thomas A.; Hovorka, O.; Wang, K. K.; Lu, B.; Ju, G. P.; Hohlfeld, J.; Bergman, B.; Koopmans, B.; Chantrell, Roy W.
2016-10-01
Controlling the relaxation of magnetization in magnetic nanostructures is key to optimizing magnetic storage device performance. This relaxation is governed by both intrinsic and extrinsic relaxation mechanisms and with the latter strongly dependent on the interactions between the nanostructures. In the present work we investigate laser induced magnetization dynamics in a broadband optical resonance type experiment revealing the role of interactions between nanostructures on the relaxation processes of granular magnetic structures. The results are corroborated by constructing a temperature dependent numerical micromagnetic model of magnetization dynamics based on the Landau-Lifshitz-Bloch equation. The model predicts a strong dependence of damping on the key material properties of coupled granular nanostructures in good agreement with the experimental data. We show that the intergranular, magnetostatic and exchange interactions provide a large extrinsic contribution to the damping. Finally we show that the mechanism can be attributed to an increase in spin-wave degeneracy with the ferromagnetic resonance mode as revealed by semianalytical spin-wave calculations.
Mukherjee, Soumya; Lu, Jingjing; Velmurugan, Gunasekaran; Singh, Shweta; Rajaraman, Gopalan; Tang, Jinkui; Ghosh, Sujit K
2016-11-07
A coordination complex family comprising of six new dinuclear symmetric lanthanide complexes, namely, [Ln2(Lx)2(L')2(CH3OH)2]·yG (H2Lx: three related yet distinct Schiff-base linkers; x = 1-3, according to the nomenclature of the Schiff-base linker employed herein. HL': 2,6-dimethoxyphenol. yG refers to crystallographically assigned guest solvent species in the respective complexes; y = number of solvent molecules; Ln(III) = Dy/Gd) were isolated employing a mixed-ligand strategy stemming out of a strategic variation of the functionalities introduced among the constituent Schiff-base linkers. The purposeful introduction of three diverse auxiliary groups with delicate differences in their electrostatic natures affects the local anisotropy and magnetic coupling of Ln(III) ion-environment in the ensuing Ln2 dinuclear complexes, consequentially resulting into distinctly dynamical magnetic behaviors among the investigated new-fangled family of isotypic Ln2 complexes. Among the entire family, subtle alterations in the chemical moieties render two of the Dy2 analogues to behave as single molecule magnets, while the other Dy2 congener merely exhibits slow relaxation of the magnetization. The current observation marks one of the rare paradigms, wherein magnetic behavior modulation was achieved by virtue of the omnipresent influence of subtly tuned linker functionalities among the constituent motifs of the lanthanide nanomagnets. To rationalize the observed difference in the magnetic coupling, density functional theory and ab initio calculations (CASSCF/RASSI-SO/POLY_ANISO) were performed on all six complexes. Subtle difference in the bond angles leads to difference in the J values observed for Gd2 complexes, while difference in the tunnel splitting associated with the structural alterations lead to variation in the magnetization blockade in the Dy2 complexes.
Magnetic Resonance Fingerprinting with short relaxation intervals.
Amthor, Thomas; Doneva, Mariya; Koken, Peter; Sommer, Karsten; Meineke, Jakob; Börnert, Peter
2017-09-01
The aim of this study was to investigate a technique for improving the performance of Magnetic Resonance Fingerprinting (MRF) in repetitive sampling schemes, in particular for 3D MRF acquisition, by shortening relaxation intervals between MRF pulse train repetitions. A calculation method for MRF dictionaries adapted to short relaxation intervals and non-relaxed initial spin states is presented, based on the concept of stationary fingerprints. The method is applicable to many different k-space sampling schemes in 2D and 3D. For accuracy analysis, T1 and T2 values of a phantom are determined by single-slice Cartesian MRF for different relaxation intervals and are compared with quantitative reference measurements. The relevance of slice profile effects is also investigated in this case. To further illustrate the capabilities of the method, an application to in-vivo spiral 3D MRF measurements is demonstrated. The proposed computation method enables accurate parameter estimation even for the shortest relaxation intervals, as investigated for different sampling patterns in 2D and 3D. In 2D Cartesian measurements, we achieved a scan acceleration of more than a factor of two, while maintaining acceptable accuracy: The largest T1 values of a sample set deviated from their reference values by 0.3% (longest relaxation interval) and 2.4% (shortest relaxation interval). The largest T2 values showed systematic deviations of up to 10% for all relaxation intervals, which is discussed. The influence of slice profile effects for multislice acquisition is shown to become increasingly relevant for short relaxation intervals. In 3D spiral measurements, a scan time reduction of 36% was achieved, maintaining the quality of in-vivo T1 and T2 maps. Reducing the relaxation interval between MRF sequence repetitions using stationary fingerprint dictionaries is a feasible method to improve the scan efficiency of MRF sequences. The method enables fast implementations of 3D spatially resolved
Mimetic Methods for Lagrangian Relaxation of Magnetic Fields
Candelaresi, Simon; Hornig, Gunnar
2014-01-01
We present a new code that performs a relaxation of a magnetic field towards a force-free state (Beltrami field) using a Lagrangian numerical scheme. Beltrami fields are of interest for the dynamics of many technical and astrophysical plasmas as they are the lowest energy states that the magnetic field can reach. The numerical method strictly preserves the magnetic flux and the topology of magnetic field lines. In contrast to other implementations we use mimetic operators for the spatial derivatives in order to improve accuracy for high distortions of the grid. Compared with schemes using direct derivatives we find that the final state of the simulation approximates a force-free state with a significantly higher accuracy. We implement the scheme in a code which runs on graphical processing units (GPU), which leads to an enhanced computing speed compared to previous relaxation codes.
Relaxation Dynamics in Heme Proteins.
Scholl, Reinhard Wilhelm
A protein molecule possesses many conformational substates that are likely arranged in a hierarchy consisting of a number of tiers. A hierarchical organization of conformational substates is expected to give rise to a multitude of nonequilibrium relaxation phenomena. If the temperature is lowered, transitions between substates of higher tiers are frozen out, and relaxation processes characteristic of lower tiers will dominate the observational time scale. This thesis addresses the following questions: (i) What is the energy landscape of a protein? How does the landscape depend on the environment such as pH and viscosity, and how can it be connected to specific structural parts? (ii) What relaxation phenomena can be observed in a protein? Which are protein specific, and which occur in other proteins? How does the environment influence relaxations? (iii) What functional form best describes relaxation functions? (iv) Can we connect the motions to specific structural parts of the protein molecule, and are these motions important for the function of the protein?. To this purpose, relaxation processes after a pressure change are studied in carbonmonoxy (CO) heme proteins (myoglobin-CO, substrate-bound and substrate-free cytochrome P450cam-CO, chloroperoxidase-CO, horseradish peroxidase -CO) between 150 K and 250 K using FTIR spectroscopy to monitor the CO bound to the heme iron. Two types of p -relaxation experiments are performed: p-release (200 to ~eq40 MPa) and p-jump (~eq40 to 200 MPa) experiments. Most of the relaxations fall into one of three groups and are characterized by (i) nonexponential time dependence and non-Arrhenius temperature dependence (FIM1( nu), FIM1(Gamma)); (ii) exponential time dependence and non-Arrhenius temperature dependence (FIM0(A_{i}to A_{j})); exponential time dependence and Arrhenius temperature dependence (FIMX( nu)). The influence of pH is studied in myoglobin-CO and shown to have a strong influence on the substate population of the
Relaxation of Magnetic Nanoparticle Chain without Applied Field*
HE Liang-Ming
2011-01-01
The relaxation ofa one-dimensional magnetic nanoparticle linear chain with lattice constant a is investigated in absence of applied field. There is an equilibrium state (or steady state) where all magnetic moments of particles lie along the chain (x-axis), back to which the magnetic nanoparticle chain at other state will relax. It is found that the relaxation time Tx is determined by Tx = 10β × a3. This relaxation is compared with that of single magnetic nanoparticle system.
On the Relaxation Dynamics of Disordered Systems
Dobramysl, Ulrich
We investigate the properties of two distinct disordered systems: the two-species predator-prey Lotka-Volterra model with rate variability, and an elastic line model to simulate vortex lines in type-II superconductors. We study the effects of intrinsic demographic variability with inheritance in the reaction rates of the Lotka-Volterra model via zero-dimensional Monte Carlo simulations as well as two-dimensional lattice simulations. Individuals of each species are assigned inheritable predation efficiencies during their creation, leading to evolutionary dynamics and thus population-level optimization. We derive an effective subspecies mean-field theory and compare its results to our numerical data. Furthermore, we introduce environmental variability via quenched spatial reaction-rate randomness. We investigate the competing effects and relative importance of the two types of variability, and find that both lead to a remarkable enhancement of the species densities, while the aforementioned optimization effects are essentially neutral in the densities. Additionally, we collected extinction time histograms for small systems and find a marked increase in the stability of the populations against extinction due to the presence of variability. We employ an elastic line model to investigate the steady-state properties and non-equilibrium relaxation kinetics of magnetic vortex lines in disordered type-II superconductors. To this end, we developed a versatile and efficient Langevin molecular dynamics simulation code, allowing us to do a careful study of samples with or without vortex-vortex interactions or disorder allows us to disentangle the various complex relaxational features present in this system and investigate their origin. In particular, we compare disordered samples with randomly distributed point defects versus correlated columnar defects. We extract two-time quantities such as the mean-square displacement, the height and density correlations, to investigate the
Relaxation Dynamics of Semiflexible Fractal Macromolecules
Jonas Mielke
2016-07-01
Full Text Available We study the dynamics of semiflexible hyperbranched macromolecules having only dendritic units and no linear spacers, while the structure of these macromolecules is modeled through T-fractals. We construct a full set of eigenmodes of the dynamical matrix, which couples the set of Langevin equations. Based on the ensuing relaxation spectra, we analyze the mechanical relaxation moduli. The fractal character of the macromolecules reveals itself in the storage and loss moduli in the intermediate region of frequencies through scaling, whereas at higher frequencies, we observe the locally-dendritic structure that is more pronounced for higher stiffness.
Influence of carriers on magnetization relaxation in (Cd,Mn)Te quantum wells
Goryca, M.; Nawrocki, M. [Institute of Experimental Physics, Warsaw University, Hoza 69, 00-681 Warsaw (Poland); Ferrand, D.; Tatarenko, S. [Joined group ' ' Nanophysique et Semiconducteurs' ' , CNRS, CEA, Universite Joseph Fourier-Grenoble, Laboratoire de Spectrometrie Physique, BP 87, 38402 Saint Martin d' Heres cedex (France); Kossacki, P.; Pacuski, W.; Maslana, W. [Institute of Experimental Physics, Warsaw University, Hoza 69, 00-681 Warsaw (Poland); Joined group ' ' Nanophysique et Semiconducteurs' ' , CNRS, CEA, Universite Joseph Fourier-Grenoble, Laboratoire de Spectrometrie Physique, BP 87, 38402 Saint Martin d' Heres cedex (France); Wojtowicz, T.; Karczewski, G. [Institute of Physics, Polish Academy of Sciences, al. Lotnikow 32/46, 02-668 Warsaw (Poland); Cibert, J. [Laboratoire Louis Neel, CNRS, BP166, 38042 Grenoble cedex 9 (France)
2007-07-01
The relaxation of the magnetization after a short pulse of magnetic field in n-doped and p-doped (Cd,Mn)Te quantum wells is determined from the giant Zeeman shift of the photoluminescence and transmission lines. This technique allows us to investigate the magnetization dynamics in zero field. In n-doped samples the magnetization relaxation is found to be faster than 20 ns. In case of p-doped samples two components of relaxation are observed. (copyright 2007 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)
Relaxation dynamics of multilayer triangular Husimi cacti
Galiceanu, Mircea; Jurjiu, Aurel
2016-09-01
We focus on the relaxation dynamics of multilayer polymer structures having, as underlying topology, the Husimi cactus. The relaxation dynamics of the multilayer structures is investigated in the framework of generalized Gaussian structures model using both Rouse and Zimm approaches. In the Rouse type-approach, we determine analytically the complete eigenvalues spectrum and based on it we calculate the mechanical relaxation moduli (storage and loss modulus) and the average monomer displacement. First, we monitor these physical quantities for structures with a fixed generation number and we increase the number of layers, such that the linear topology will smoothly come into play. Second, we keep constant the size of the structures, varying simultaneously two parameters: the generation number of the main layer, G, and the number of layers, c. This fact allows us to study in detail the crossover from a pure Husimi cactus behavior to a predominately linear chain behavior. The most interesting situation is found when the two limiting topologies cancel each other. For this case, we encounter in the intermediate frequency/time domain regions of constant slope for different values of the parameter set (G, c) and we show that the number of layers follows an exponential-law of G. In the Zimm-type approach, which includes the hydrodynamic interactions, the quantities that describe the mechanical relaxation dynamics do not show scaling behavior as in the Rouse model, except the limiting case, namely, a very high number of layers and low generation number.
Slowing hot-carrier relaxation in graphene using a magnetic field
Plochocka, P.; Kossacki, P.; Golnik, A.; Kazimierczuk, T.; Berger, C.; de Heer, W. A.; Potemski, M.
2009-12-01
A degenerate pump-probe technique is used to investigate the nonequilibrium carrier dynamics in multilayer graphene. Two distinctly different dynamics of the carrier relaxation are observed. A fast relaxation (˜50fs) of the carriers after the initial effect of phase-space filling followed by a slower relaxation (˜4ps) due to thermalization. Both relaxation processes are less efficient when a magnetic field is applied at low temperatures which is attributed to the suppression of the electron-electron Auger scattering due to the nonequidistant Landau-level spacing of the Dirac fermions in graphene.
Spin relaxation of radicals in low and zero magnetic field
Fedin, M. V.; Purtov, P. A.; Bagryanskaya, E. G.
2003-01-01
Spin relaxation of radicals in solution in low and zero magnetic field has been studied theoretically. The main relaxation mechanisms in low magnetic field [modulation of anisotropic and isotropic hyperfine interaction, and modulation of spin-rotational interaction] are considered within a Redfield theory. The analytical results for a radical with one magnetic nucleus (I=1/2) and for a radical with two equivalent magnetic nuclei (I=1/2) are obtained and analyzed. It is shown that the probabilities of relaxational transitions in low and zero magnetic fields differ significantly from the probabilities in high magnetic fields. The use of high-field expressions in low and zero magnetic fields is not correct. Taking exact account of spin relaxation is important in calculations of much low-field magnetic resonance data.
Schlüter, Steffen [School of Chemical, Biological and Environmental Engineering, Oregon State University, Corvallis Oregon USA; Department Soil Physics, Helmholtz-Centre for Environmental Research-UFZ, Halle Germany; Berg, Steffen [Shell Global Solutions International B.V., Rijswijk Netherlands; Li, Tianyi [School of Chemical, Biological and Environmental Engineering, Oregon State University, Corvallis Oregon USA; Vogel, Hans-Jörg [Department Soil Physics, Helmholtz-Centre for Environmental Research-UFZ, Halle Germany; Institut für Agrar- und Ernährungswissenschaften, Martin-Luther-Universität Halle-Wittenberg, Halle Germany; Wildenschild, Dorthe [School of Chemical, Biological and Environmental Engineering, Oregon State University, Corvallis Oregon USA
2017-06-01
The relaxation dynamics toward a hydrostatic equilibrium after a change in phase saturation in porous media is governed by fluid reconfiguration at the pore scale. Little is known whether a hydrostatic equilibrium in which all interfaces come to rest is ever reached and which microscopic processes govern the time scales of relaxation. Here we apply fast synchrotron-based X-ray tomography (X-ray CT) to measure the slow relaxation dynamics of fluid interfaces in a glass bead pack after fast drainage of the sample. The relaxation of interfaces triggers internal redistribution of fluids, reduces the surface energy stored in the fluid interfaces, and relaxes the contact angle toward the equilibrium value while the fluid topology remains unchanged. The equilibration of capillary pressures occurs in two stages: (i) a quick relaxation within seconds in which most of the pressure drop that built up during drainage is dissipated, a process that is to fast to be captured with fast X-ray CT, and (ii) a slow relaxation with characteristic time scales of 1–4 h which manifests itself as a spontaneous imbibition process that is well described by the Washburn equation for capillary rise in porous media. The slow relaxation implies that a hydrostatic equilibrium is hardly ever attained in practice when conducting two-phase experiments in which a flux boundary condition is changed from flow to no-flow. Implications for experiments with pressure boundary conditions are discussed.
Control of Transport-barrier relaxations by Resonant Magnetic Perturbations
Leconte, M; Garbet, X; Benkadda, S
2009-01-01
Transport-barrier relaxation oscillations in the presence of resonant magnetic perturbations are investigated using three-dimensional global fluid turbulence simulations from first principles at the edge of a tokamak. It is shown that resonant magnetic perturbations have a stabilizing effect on these relaxation oscillations and that this effect is due mainly to a modification of the pressure profile linked to the presence of both residual residual magnetic island chains and a stochastic layer.
Wen-Hsien Li
2016-05-01
Full Text Available We report on the generation of large inverse remanent magnetizations in nano-sized core/shell structure of Au/Ni by turning off the applied magnetic field. The remanent magnetization is very sensitive to the field reduction rate as well as to the thermal and field processes before the switching off of the magnetic field. Spontaneous reversal in direction and increase in magnitude of the remanent magnetization in subsequent relaxations over time were found. All of the various types of temporal relaxation curves of the remanent magnetizations are successfully scaled by a stretched exponential decay profile, characterized by two pairs of relaxation times and dynamic exponents. The relaxation time is used to describe the reduction rate, while the dynamic exponent describes the dynamical slowing down of the relaxation through time evolution. The key to these effects is to have the induced eddy current running beneath the amorphous Ni shells through Faraday induction.
Magnetic relaxations in a Tb-based single molecule magnet studied by quasielastic neutron scattering
Kofu, Maiko [Institute for Solid State Physics, University of Tokyo, Kashiwa, Chiba 277-8581 (Japan); Kajiwara, Takashi [Faculty of Science, Nara Women’s University, Nara, Nara 630-8506 (Japan); Gardner, Jason S. [NIST Center for Neutron Research, National Institute of Standards and Technology, 100 Bureau Drive, Gaithersburg, MD 20899-6102 (United States); Simeoni, Giovanna G. [Technische Universität München, Forschungsneutronenquelle Heinz Maier-Leibnitz FRM II, D-85747 Garching (Germany); Tyagi, Madhusudan; Faraone, Antonio [NIST Center for Neutron Research, National Institute of Standards and Technology, 100 Bureau Drive, Gaithersburg, MD 20899-6102 (United States); Department of Materials Science, University of Maryland, College Park, MD 20742 (United States); Nakajima, Kenji; Ohira-Kawamura, Seiko [Neutron Science Section, J-PARC Center, Tokai, Ibaraki 319-1195 (Japan); Nakano, Motohiro [Graduate School of Engineering, Osaka University, Suita, Osaka 565-0871 (Japan); Yamamuro, Osamu, E-mail: yamamuro@issp.u-tokyo.ac.jp [Institute for Solid State Physics, University of Tokyo, Kashiwa, Chiba 277-8581 (Japan)
2013-12-12
Highlights: • We examined a Tb based single molecule magnet by ac susceptibility and QENS. • We found two distinct magnetic relaxations in a wide time range from 0.1 ms to 1 ps. • The slower relaxation corresponds to the thermally activated tunneling process. • The faster one couples with the motion of H atoms around the magnetic ions. • The two relaxations exhibit a crossover around 100 ns. - Abstract: By using ac magnetic susceptibility and quasielatic neutron scattering (QENS) techniques, we have investigated a magnetization relaxation phenomenon of a rare-earth based single molecule magnet, TbCuC{sub 19}H{sub 20}N{sub 3}O{sub 16}. We clearly identified and characterized two magnetic relaxations. The slower relaxation observed in the ac susceptibility is at the ms timescale around T=2 K and its activation energy is 16 K. On the other hand, the faster relaxation in the QENS measurements occurs on the timescale between ns and ps with activation energy of 174 K. The slower relaxation may occur through thermally activated tunneling among magnetic substates. We discuss two possible origins for the faster relaxation; one is a thermally activated tunneling between the higher excited states, the other is the magnetic relaxation coupled with the motion of ligands around the magnetic ions. This is the first clear observation of magnetic relaxation on the single molecule magnet revealed by QENS.
Dynamical magnetic effects in photoexcited ferromagnetic semiconductors
Chovan, J. [Institute of Electronic Structure and Laser, Foundation for Research and Technology-Hellas, P. O. Box 1527, 711 10 Heraklion (Greece); Kavousanaki, E.G. [Department of Physics, University of Crete, P. O. Box 2208, 710 03 Heraklion (Greece); Perakis, I.E. [Institute of Electronic Structure and Laser, Foundation for Research and Technology-Hellas, P. O. Box 1527, 711 10 Heraklion (Greece); Department of Physics, University of Crete, P. O. Box 2208, 710 03 Heraklion (Greece)
2006-08-15
We develop a theory of photoinduced dynamical magnetic effects in III-Mn-V ferromagnetic semiconductors valid in presence of strong carrier spin relaxation and dephasing. We treat relaxation by using the Lindblad semigroup method and calculate the nonlinear response numerically. We predict Mn-spin relaxation and precession towards the direction determined by nonlinear optical polarization. These effects occur during the pulse. (copyright 2006 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)
Using relaxational dynamics to reduce network congestion
Piontti, Ana L. Pastore y.; La Rocca, Cristian E.; Toroczkai, Zoltán; Braunstein, Lidia A.; Macri, Pablo A.; López, Eduardo
2008-09-01
We study the effects of relaxational dynamics on congestion pressure in scale-free (SF) networks by analyzing the properties of the corresponding gradient networks (Toroczkai and Bassler 2004 Nature 428 716). Using the Family model (Family and Bassler 1986 J. Phys. A: Math. Gen. 19 L441) from surface-growth physics as single-step load-balancing dynamics, we show that the congestion pressure considerably drops on SF networks when compared with the same dynamics on random graphs. This is due to a structural transition of the corresponding gradient network clusters, which self-organize so as to reduce the congestion pressure. This reduction is enhanced when lowering the value of the connectivity exponent λ towards 2.
Magnetic Relaxation and Coercivity of Finite-size Single Chain Magnets
Gredig, Thomas; Byrne, Matthew; Vindigni, Alessandro
2015-03-01
The magnetic coercivity of hysteresis loops for iron phthalocyanine thin films depends on the iron chain length and the measurement sweep speed below 5 K. The average one-dimensional (1D) iron chain length in samples is controlled during deposition. These 1D iron chains can be tuned over one order of magnitude with the shortest chain having 100 elements. We show that the coercivity strongly increases with the average length of the iron chains, which self-assemble parallel to the substrate surface. Magnetic relaxation and sweep speed data suggest spin dynamics play an important role. Implementing Glauber dynamics with a finite-sized 1D Ising model provides qualitative agreement with experimental data. This suggests that iron phthalocyanine thin films act as single chain magnets and provide a solid test system for tunable finite-sized magnetic chains. This research has been supported with the NSF-DMR 0847552 grant.
Ultrafast magnetization dynamics in diluted magnetic semiconductors
Morandi, O [INRIA Nancy Grand-Est and Institut de Recherche en Mathematiques Avancees, 7 rue Rene Descartes, F-67084 Strasbourg (France); Hervieux, P-A; Manfredi, G [Institut de Physique et Chimie des Materiaux de Strasbourg, 23 rue du Loess, F-67037 Strasbourg (France)], E-mail: morandi@dipmat.univpm.it
2009-07-15
We present a dynamical model that successfully explains the observed time evolution of the magnetization in diluted magnetic semiconductor quantum wells after weak laser excitation. Based on the pseudo-fermion formalism and a second-order many-particle expansion of the exact p-d exchange interaction, our approach goes beyond the usual mean-field approximation. It includes both the sub-picosecond demagnetization dynamics and the slower relaxation processes that restore the initial ferromagnetic order in a nanosecond timescale. In agreement with experimental results, our numerical simulations show that, depending on the value of the initial lattice temperature, a subsequent enhancement of the total magnetization may be observed within the timescale of a few hundred picoseconds.
Generalized dynamic scaling for quantum critical relaxation in imaginary time.
Zhang, Shuyi; Yin, Shuai; Zhong, Fan
2014-10-01
We study the imaginary-time relaxation critical dynamics of a quantum system with a vanishing initial correlation length and an arbitrary initial order parameter M0. We find that in quantum critical dynamics, the behavior of M0 under scale transformations deviates from a simple power law, which was proposed for very small M0 previously. A universal characteristic function is then suggested to describe the rescaled initial magnetization, similar to classical critical dynamics. This characteristic function is shown to be able to describe the quantum critical dynamics in both short- and long-time stages of the evolution. The one-dimensional transverse-field Ising model is employed to numerically determine the specific form of the characteristic function. We demonstrate that it is applicable as long as the system is in the vicinity of the quantum critical point. The universality of the characteristic function is confirmed by numerical simulations of models belonging to the same universality class.
Nuclear magnetic resonance relaxation in multiple sclerosis
Larsson, H B; Barker, G J; MacKay, A
1998-01-01
OBJECTIVES: The theory of relaxation processes and their measurements are described. An overview is presented of the literature on relaxation time measurements in the normal and the developing brain, in experimental diseases in animals, and in patients with multiple sclerosis. RESULTS...... AND CONCLUSION: Relaxation time measurements provide insight into development of multiple sclerosis plaques, especially the occurrence of oedema, demyelination, and gliosis. There is also evidence that normal appearing white matter in patients with multiple sclerosis is affected. What is now needed are fast...
Relaxation in x-space magnetic particle imaging.
Croft, Laura R; Goodwill, Patrick W; Conolly, Steven M
2012-12-01
Magnetic particle imaging (MPI) is a new imaging modality that noninvasively images the spatial distribution of superparamagnetic iron oxide nanoparticles (SPIOs). MPI has demonstrated high contrast and zero attenuation with depth, and MPI promises superior safety compared to current angiography methods, X-ray, computed tomography, and magnetic resonance imaging angiography. Nanoparticle relaxation can delay the SPIO magnetization, and in this work we investigate the open problem of the role relaxation plays in MPI scanning and its effect on the image. We begin by amending the x-space theory of MPI to include nanoparticle relaxation effects. We then validate the amended theory with experiments from a Berkeley x-space relaxometer and a Berkeley x-space projection MPI scanner. Our theory and experimental data indicate that relaxation reduces SNR and asymmetrically blurs the image in the scanning direction. While relaxation effects can have deleterious effects on the MPI scan, we show theoretically and experimentally that x-space reconstruction remains robust in the presence of relaxation. Furthermore, the role of relaxation in x-space theory provides guidance as we develop methods to minimize relaxation-induced blurring. This will be an important future area of research for the MPI community.
Magnetic relaxation behaviour in Pr2NiSi3
Pakhira, Santanu; Mazumdar, Chandan; Ranganathan, R.
2016-05-01
Time dependent isothemal remanent magnetizatin (IRM) behaviour for polycrystalline compound Pr2NiSi3 have been studied below its characteristic temperature. The compound undergoes slow magnetic relaxation with time. Along with competing interaction, non-magnetic atom disorder plays an important role in formation of non-equilibrium glassy like ground state for this compound.
Measuring Propellant Stress Relaxation Modulus Using Dynamic Mechanical Analyzer
2017-03-29
P. N., Singh, P. P., and Bhattacharya, B., “Determination of Activation Energy of Relaxation Events in Composite Solid Propellants by Dynamic...Article 3. DATES COVERED (From - To) 04 August 2016 – 29 March 2017 4. TITLE AND SUBTITLE Measuring Propellant Stress Relaxation Modulus Using Dynamic...ERC 14. ABSTRACT A method for determining the stress relaxation master curve of solid rocket propellants was developed. The propellant was tested in
Nan, Tianxiang; Emori, Satoru; Wang, Xinjun; Hu, Zhongqiang; Xie, Li; Gao, Yuan; Lin, Hwaider; Sun, Nian, E-mail: n.sun@neu.edu [Department of Electrical and Computer Engineering, Northeastern University, Boston, Massachusetts 02115 (United States); Peng, Bin; Liu, Ming, E-mail: mingliu@mail.xjtu.edu.cn [Electronic Materials Research Laboratory, Xi' an Jiaotong University, Xi' an 710049 (China); Jiao, Jie; Luo, Haosu [Shanghai Institute of Ceramics, Chinese Academy of Sciences, Shanghai 201800 (China); Budil, David [Department of Chemistry, Northeastern University, Boston, Massachusetts 02115 (United States); Jones, John G.; Howe, Brandon M.; Brown, Gail J. [Materials and Manufacturing Directorate, Air Force Research Laboratory, Wright-Patterson AFB, Ohio 45433 (United States)
2016-01-04
Electric-field modulation of magnetism in strain-mediated multiferroic heterostructures is considered a promising scheme for enabling memory and magnetic microwave devices with ultralow power consumption. However, it is not well understood how electric-field-induced strain influences magnetic relaxation, an important physical process for device applications. Here, we investigate resonant magnetization dynamics in ferromagnet/ferroelectric multiferroic heterostructures, FeGaB/PMN-PT and NiFe/PMN-PT, in two distinct strain states provided by electric-field-induced ferroelectric phase transition. The strain not only modifies magnetic anisotropy but also magnetic relaxation. In FeGaB/PMN-PT, we observe a nearly two-fold change in intrinsic Gilbert damping by electric field, which is attributed to strain-induced tuning of spin-orbit coupling. By contrast, a small but measurable change in extrinsic linewidth broadening is attributed to inhomogeneous ferroelastic domain switching during the phase transition of the PMN-PT substrate.
Nan, Tianxiang; Emori, Satoru; Peng, Bin; Wang, Xinjun; Hu, Zhongqiang; Xie, Li; Gao, Yuan; Lin, Hwaider; Jiao, Jie; Luo, Haosu; Budil, David; Jones, John G.; Howe, Brandon M.; Brown, Gail J.; Liu, Ming; Sun, Nian
2016-01-01
Electric-field modulation of magnetism in strain-mediated multiferroic heterostructures is considered a promising scheme for enabling memory and magnetic microwave devices with ultralow power consumption. However, it is not well understood how electric-field-induced strain influences magnetic relaxation, an important physical process for device applications. Here, we investigate resonant magnetization dynamics in ferromagnet/ferroelectric multiferroic heterostructures, FeGaB/PMN-PT and NiFe/PMN-PT, in two distinct strain states provided by electric-field-induced ferroelectric phase transition. The strain not only modifies magnetic anisotropy but also magnetic relaxation. In FeGaB/PMN-PT, we observe a nearly two-fold change in intrinsic Gilbert damping by electric field, which is attributed to strain-induced tuning of spin-orbit coupling. By contrast, a small but measurable change in extrinsic linewidth broadening is attributed to inhomogeneous ferroelastic domain switching during the phase transition of the PMN-PT substrate.
Relaxing the Bounds on Primordial Magnetic Seed Fields
1999-01-01
We point out that the lower bound on the primordial magnetic field required to seed the galactic dynamo is significantly relaxed in an open universe or in a universe with a positive cosmological constant. It is shown that, for reasonable cosmological parameters, primordial seed fields of strength 10^{-30} Gauss or less at the time of galaxy formation could explain observed galactic magnetic fields. As a consequence, mechanisms of primordial magnetic seed-field generation that have previously ...
On-chip measurements of Brownian relaxation vs. concentration of 40nm magnetic beads
Østerberg, Frederik Westergaard; Rizzi, Giovanni; Hansen, Mikkel Fougt
2012-01-01
are needed as the beads are magnetized by the field generated by the applied sensor bias current. We show that the Brownian relaxation frequency can be extracted from fitting the Cole-Cole model to measurements for bead concentrations of 64 mu g/ml or higher and that the measured dynamic magnetic response......We present on-chip Brownian relaxation measurements on a logarithmic dilution series of 40 nm beads dispersed in water with bead concentrations between 16 mu g/ml and 4000 mu g/ml. The measurements are performed using a planar Hall effect bridge sensor at frequencies up to 1 MHz. No external fields...
Proton magnetic relaxation dispersion in aqueous biopolymer systems
Conti, S.
Investigation of the magnetic field dependence of proton spin-lattice relaxation in solutions of bovine fibrinogen has been performed for Larmor frequencies between 50 Hz and 60 MHz, and complemented with measurements of spin-spin relaxation rates at 2 kHz and 25 MHz. A thorough analysis of experimental data, including the effects of protein concentration, temperature, pH and isotopic dilution, leads to an overall relaxation scheme consistent with T1 and T2 values at both low and high magnetic fields. The scheme involves water molecules slightly anisotropically bound on proteins as well as slow exchanging protein protons magnetically coupled to solute nuclei. A coherent picture, reminiscent of the traditional hydration layer, can be obtained for bound water. A major conclusion is that transfer of single protons may contribute substantially to the chemical exchange between free and bound water.
The study of magnetic properties and relaxation processes in Co/Au bimetallic nanoparticles
Hrubovčák, Pavol [Department of Condensed Matter Physics, P.J. Šafárik University, Park Angelinum 9, Košice (Slovakia); Zeleňáková, Adriana, E-mail: adriana.zelenakova@upjs.sk [Department of Condensed Matter Physics, P.J. Šafárik University, Park Angelinum 9, Košice (Slovakia); Zeleňák, Vladimir [Department of Inorganic Chemistry, P.J. Šafárik University, Moyzesova 11, Košice (Slovakia); Kováč, Jozef [Institute of Experimental Physics, SAS, Watsonova 41, Košice (Slovakia)
2015-11-15
Co/Au bimetallic fine nanoparticles were prepared employing the method of microemulsion using reverse micelle as nanoreactor, controlling the particles size. Magnetic and structural properties of two different samples Co/Au1 and Co/Au2 with almost comparable size of Co core and different size of Au layer were studied. The investigation of magnetic relaxation processes present in the particles was carried out by means of ac and dc magnetization data obtained at different temperatures and magnitudes of magnetic field. We observed the existence of superspin glass state characterized by the strong inter-particle interactions in the nanoparticle systems. In this paper, we discuss the attributes of novel superspin glass magnetic state reflected on various features (saturated FC magnetization at low temperatures, shift of the Cole–Cole arc downwards) and calculated parameters (relaxation time, critical exponent zv ∼ 10 and frequency dependent criterion p < 0.05). Comparison of the magnetic properties of two studied samples show that the thickness of diamagnetic Au shell significantly influences the magnetic interactions and change the relaxation dynamics. - Highlights: • Co/Au fine nanoparticles prepared by reverse micelle as nanoreactor, controlling the size. • Existence of superspin glass state confirmed from ac magnetic susceptibility study. • Individual particles exhibit the collective behavior below glass temperature T{sub SSG}. • Influence of diamagnetic shell on the magnetic properties of core–shell nanoparticles.
Surface hopping investigation of the relaxation dynamics in radical cations
Assmann, Mariana; Matsika, Spiridoula, E-mail: smatsika@temple.edu [Department of Chemistry, Temple University, Philadelphia, Pennsylvania 19122 (United States); Weinacht, Thomas [Department of Physics, Stony Brook University, Stony Brook, New York 11794 (United States)
2016-01-21
Ionization processes can lead to the formation of radical cations with population in several ionic states. In this study, we examine the dynamics of three radical cations starting from an excited ionic state using trajectory surface hopping dynamics in combination with multiconfigurational electronic structure methods. The efficiency of relaxation to the ground state is examined in an effort to understand better whether fragmentation of cations is likely to occur directly on excited states or after relaxation to the ground state. The results on cyclohexadiene, hexatriene, and uracil indicate that relaxation to the ground ionic state is very fast in these systems, while fragmentation before relaxation is rare. Ultrafast relaxation is facilitated by the close proximity of electronic states and the presence of two- and three-state conical intersections. Examining the properties of the systems in the Franck-Condon region can give some insight into the subsequent dynamics.
Magnetic anisotropy and mechanism of magnetic relaxation in Er(III) single-ion magnets.
Singh, Saurabh Kumar; Gupta, Tulika; Rajaraman, Gopalan
2014-10-20
Magnetic anisotropy is a key component in the design of single-molecule magnets (SMMs) possessing a large barrier height for magnetization reversal. Lanthanide-based SMMs are the most promising candidates in this arena as they offer a large magnetic anisotropy due to the presence of strong spin-orbit coupling. Among lanthanides, Er(III) complexes are gaining attention in the area of SMMs, because of their intriguing magnetic properties and attractive blocking temperatures. Here, we have undertaken detailed ab initio calculations on four structurally diverse Er(III) SMMs to shed light on how the magnetic anisotropy is influenced by the role of symmetry and structural distortions. The employed CASSCF+RASSI calculations have offered rationale for the observed differences in the estimated Ueff values for the studied complexes and also offered hints to the mechanism of magnetic relaxation. The differences in the mechanism of magnetic relaxations are further analyzed based on the Er-ligand interactions, which is obtained by analyzing the charges, densities, luminescent behavior and the frontier molecular orbitals. Our calculations, for the first time, have highlighted the importance of high symmetry environment and ligand donor strength in obtaining large Ueff values for the Er(III) complexes. We have examined these possibilities by modeling several structures with variable coordination numbers and point group symmetry. These results signify the need of a detailed understanding on the shape of the anisotropy and the point group symmetry in order to achieve large Ueff values in Er(III) single-ion magnets.
Relaxation towards phase-locked dynamics in long Josephson junctions
Salerno, M.; Grønbech-Jensen, Niels; Samuelsen, Mogens Rugholm
1995-01-01
We study the relaxation phenomenon towards phase-locked dynamics in long Josephson junctions. In particular the dependence of the relaxation frequency for the equal time of flight solution on the junction parameters is derived. The analysis is based on a phase-locked map and is compared with dire...
Lisovaya E. V.; Victorova E. P.; Agafonov O. S.; Kornen N. N.; Shahray T. A.
2015-01-01
The article presents a comparative assessment and peculiarities of nuclear magnetic relaxation characteristics of rapeseed and sunflower lecithin. It was established, that lecithin’s nuclear magnetic relaxation characteristics, namely, protons’ spin-spin relaxation time and amplitudes of nuclear magnetic relaxation signals of lecithin components, depend on content of oil’s fat acids and phospholipids, contained in the lecithin. Comparative assessment of protons’ spin-spin relaxation time of r...
Østerberg, Frederik W.; Dalslet, Bjarke T.; Snakenborg, Detlef; Johansson, Christer; Hansen, Mikkel F.
2010-12-01
We present a simple `click-on' fluidic system with integrated electrical contacts, which is suited for electrical measurements on chips in microfluidic systems. We show that microscopic magnetic field sensors based on the planar Hall effect can be used for detecting the complex magnetic response using only the self-field arising from the bias current applied to the sensors as excitation field. We present measurements on a suspension of magnetic beads with a nominal diameter of 250 nm vs. temperature and find that the observations are consistent with the Cole-Cole model for Brownian relaxation with a constant hydrodynamic bead diameter when the temperature dependence of the viscosity of water is taken into account. These measurements demonstrate the feasibility of performing measurements of the Brownian relaxation response in a lab-on-a-chip system and constitute the first step towards an integrated biosensor based on the detection of the dynamic response of magnetic beads.
(1)H NMR Relaxation Study of a Magnetic Ionic Liquid as a Potential Contrast Agent.
Daniel, Carla I; Vaca Chávez, Fabián; Portugal, Carla A M; Crespo, João G; Sebastião, Pedro J
2015-09-03
A proton nuclear magnetic relaxation dispersion (1)H NMRD study of the molecular dynamics in mixtures of magnetic ionic liquid [P66614][FeCl4] with [P66614][Cl] ionic liquid and mixtures of [P66614][FeCl4] with dimethyl sulfoxide (DMSO) is presented. The proton spin-lattice relaxation rate, R1, was measured in the frequency range of 8 kHz-300 MHz. The viscosity of the binary mixtures was measured as a function of an applied magnetic field, B, in the range of 0-2 T. In the case of DMSO/[P66614][FeCl4] the viscosity was found to be independent from the magnetic field, while in the case of the [P66614][Cl]/[P66614][FeCl4] system viscosity decreased with the increase of the magnetic field strength. The spin-lattice relaxation results were analyzed for all systems taking into account the relaxation mechanisms associated with the molecular motions with correlation times in a range between 10(-11) and 10(-7)s, usually observed by NMRD, and the paramagnetic relaxation contributions associated with the presence of the magnetic ions in the systems. In the case of the DMSO/[P66614][FeCl4] system the R1 dispersion shows the relaxation enhancement due to the presence of the magnetic ions, similar to that reported for contrast agents. For the [P66614][Cl]/[P66614][FeCl4] system, the R1 dispersion presents a much larger paramagnetic relaxation contribution, in comparison with that observed for the DMSO/[P66614][FeCl4] mixtures but different from that reported for other magnetic ionic liquid system. In the [P66614][Cl]/[P66614][FeCl4] system the relaxation enhancement associated with the paramagnetic ions is clearly not proportional to the concentration of magnetic ions, in contrast with what is observed for the DMSO/[P66614][FeCl4] system.
Relaxation Dynamics in Condensation on Weighted Scale-Free Networks
MENG Xin-He; TANG Ming; WANG Peng; LIU Zong-Hua
2008-01-01
Most of the realistic networks are weighted scale-free networks. How this structure influences the conden-sation on it is a challenging problem. Recently, we make a first step to discuss its condensation [Phys. Rev. E 74 (2006) 036101] and here we focus on its evolutionary process of phase transition. In order to show how the weighted transport influences the dynamical properties, we study the relaxation dynamics in a zero range process on weighted scale-free networks. We find that there is a hierarchical relaxation dynamics in the evolution and there is a scaling relation between the relaxation time and the jumping exponent. The relaxation dynamics can be illustrated by a mean-field equation. The theoretical predictions are confirmed by our numerical simulations.
P. Arosio; M. Corti; Mariani, M; Orsini, F.; Bogani, L.; A. CANESCHI; Lago, J.; Lascialfari, A.
2015-01-01
The spin dynamics of the molecular magnetic chain [Dy(hfac)(3){NIT(C6H4OPh)}] were investigated by means of the Muon Spin Relaxation (mu+SR) technique. This system consists of a magnetic lattice of alternating Dy(III) ions and radical spins, and exhibits single-chain-magnet behavior. The magnetic properties of [Dy(hfac)(3){NIT(C6H4OPh)}] have been studied by measuring the magnetization vs. temperature at different applied magnetic fields (H - 5, 3500, and 16500 Oe) and by performing mu+SR exp...
Berry, St
2000-07-01
This experimental study of the magnetic field-temperature phase diagram and of the vortex dynamics in high- T{sub c} superconductors focuses on Bismuth-based cuprates: Bi{sub 2}Sr{sub 2}CaCu{sub 2}O{sub 8}. In type-II superconductors, mixed state characterized by the presence of vortices (quanta of magnetic flux) is divided by a transition line determined by two features of magnetization loops. For T > 40 K, magnetization loops vs applied field show a step evidence of a first order transition. From 20 to 40 K, a second peak replacing the step correspond to an abrupt increase of irreversibility interpreted as a bulk current. We want to understand the nature of the second peak (thermodynamic or nonequilibrium property) and separate phenomena contributing to irreversibility (flux pinning, geometrical or surface effects). Magnetic measurement techniques are nondestructive and have a resolution of few microns. Bi{sub 2}Sr{sub 2}CaCu{sub 2}O{sub 8} single crystals are optimized by localizing defectives regions with a magneto-optic technique for flux imaging and elimination of these regions with a wire saw. Local magnetization loops and relaxation measurements performed with a microscopic Hall probe array allow to distinguish irreversibility sources. The shape of induction profiles indicates which current dominate between surface current and bulk pinning induced current. Two crossover with time and a direct observation of two phases coexistence in induction profiles enlighten phenomena in play. The measured electric field-current density characteristics lead to barrier energy U(j) controlling thermally activated flux motion. Three relations (U(j) (surface, bulk low and high field) explain second peak. (author)
Dynamics of cosmological relaxation after reheating
Choi, Kiwoon; Sekiguchi, Toyokazu
2016-01-01
We examine if the cosmological relaxation mechanism, which was proposed recently as a new solution to the hierarchy problem, can be compatible with high reheating temperature well above the weak scale. As the barrier potential disappears at high temperature, the relaxion rolls down further after the reheating, which may ruin the successful implementation of the relaxation mechanism. It is noted that if the relaxion is coupled to a dark gauge boson, the new frictional force arising from dark gauge boson production can efficiently slow down the relaxion motion, which allows the relaxion to be stabilized after the electroweak phase transition for a wide range of model parameters, while satisfying the known observational constraints.
Measurement of Magnetization Curve and Magnetic Relaxation for 2H-NbSe2 Crystals
Zhang Ning; Liu Hai-lin; Yu Zhu-xing; Xiong Rui; Shi Jing
2004-01-01
The characteristics of electronic transport properties: behaviors of magnetization curve and magnetic relaxation of a typical normal superconductor 2H-NbSe2 are investigated. The results show that TCand ΔTC of the samples are 7.2,0.18 K, indicating that superconducting energy gap at zero temperature is 1.1 meV. No fish tail shape is found in the magnetization curves at several temperatures. The relationship between remnant magnetic moment and time reveals that the magnetic flux creep of the sample agrees with the Kim-Anderson thermal activation model with the relaxation rate S=0.000 36 at T=6 K.
Habib, Fatemah; Lin, Po-Heng; Long, Jérôme; Korobkov, Ilia; Wernsdorfer, Wolfgang; Murugesu, Muralee
2011-06-15
The magnetic dilution method was employed in order to elucidate the origin of the slow relaxation of the magnetization in a Dy(2) single-molecule magnet (SMM). The doping effect was studied using SQUID and micro-SQUID measurements on a Dy(2) SMM diluted in a diamagnetic Y(2) matrix. The quantum tunneling of the magnetization that can occur was suppressed by applying optimum dc fields. The dominant single-ion relaxation was found to be entangled with the neighboring Dy(III) ion relaxation within the molecule, greatly influencing the quantum tunneling of the magnetization in this complex.
Thermal relaxation of magnetic clusters in amorphous Hf_{57}Fe_{43} alloy
Pajic, Damir; Zadro, Kreso; Ristic, Ramir; Zivkovic, Ivica; Skoko, Zeljko; Babic, Emil
2006-01-01
The magnetization processes in binary magnetic/nonmagnetic amorphous alloy Hf_{57}Fe_{43} are investigated by the detailed measurements of magnetic hysteresis loops, temperature dependence of magnetization, relaxation of magnetization and magnetic ac susceptibility, including a nonlinear term. Blocking of magnetic moments at lower temperatures is accompanied with the slow relaxation of magnetization and magnetic hysteresis loops. All of the observed properties are explained with the superpara...
Structural and magnetic relaxations of mechanically alloyed Fe-Mo
Jiraskova, Y.; Bursik, J.; Turek, I.; Cizek, J.; Prochazka, I.
2014-10-01
The Fe-Mo sample mechanically alloyed for 250 h under air atmosphere was exposed to a series of isothermal and isochronal treatments with the aim to follow changes in the structure and magnetic properties regarding relaxations of strains and defects and stability of chemical composition. For this purpose x-ray diffraction, positron annihilation, scanning and transmission electron microscopy, and Mössbauer spectrometry were applied and supplemented by magnetic measurements. The temperatures for the magnetic studies were selected from the thermomagnetic curve of the as-prepared sample. The time interval of isothermal treatments was chosen from 0-300 min. The Mo content in the bcc-Fe(Mo) phase has substantially exceeded the equilibrium solubility limit but it has been found to decrease under the thermal treatment which was reflected by decreasing lattice parameters. The small crystallite size of approximately 10 nm in the initial state starts to grow only after a certain amount of strains induced by severe deformation, due to mechanical alloying being released. This was also reflected in the magnetic parameters. From their time dependences at selected temperatures the characteristic relaxation times were obtained and used for a calculation of the activation enthalpy of relaxation processes.
Size-dependent MR relaxivities of magnetic nanoparticles
Joos, Alexander; Löwa, Norbert; Wiekhorst, Frank; Gleich, Bernhard; Haase, Axel
2017-04-01
Magnetic nanoparticles (MNPs) can be used as carriers for magnetic drug targeting and for stem cell tracking by magnetic resonance imaging (MRI). For these applications, it is crucial to quantitatively determine the spatial distribution of the MNP concentration, which can be approached by MRI relaxometry. Theoretical considerations and experiments have shown that R2 relaxation rates are sensitive to the aggregation state of the particles, whereas R2* is independent of aggregation state and therefore suited for MNP quantification if the condition of static dephasing is met. We present a new experimental approach to characterize an MNP system with respect to quantitative MRI based on hydrodynamic fractionation. The first results qualitatively confirm the outer sphere relaxation theory for small MNPs and show that the two commercial MRI contrast agents Resovist® and Endorem® should not be used for quantitative MRI because they do not fulfill the condition for static dephasing. Our approach could facilitate the choice of MNPs for quantitative MRI and help clarifying the relationship between size, magnetism and relaxivity of MNPs in the future.
Donolato, M.; Sogne, E.; Dalslet, Bjarke Thomas
2011-01-01
We demonstrate the detection of the Brownian relaxation frequency of 250 nm diameter magnetic beads using a lab-on-chip platform based on current lines for exciting the beads with alternating magnetic fields and highly sensitive magnetic tunnel junction (MTJ) sensors with a superparamagnetic free...
Carroll, Matthew R J; House, Michael J; Woodward, Robert C; St Pierre, Timothy G [School of Physics, University of Western Australia, 35 Stirling Hwy, Crawley, WA 6009 (Australia); Huffstetler, Phillip P; Miles, William C; Goff, Jonathon D; Davis, Richey M; Riffle, Judy S, E-mail: stpierre@physics.uwa.edu.au [Macromolecules and Interfaces Institute, Virginia Polytechnic Institute and State University, Blacksburg, VA 24061 (United States)
2011-08-12
Iron oxide magnetic nanoparticles are good candidates for magnetic resonance imaging (MRI) contrast agents due to their high magnetic susceptibilities. Here we investigate 19 polyether-coated magnetite nanoparticle systems comprising three series. All systems were synthesized from the same batch of magnetite nanoparticles. A different polyether was used for each series. Each series comprised systems with systematically varied polyether loadings per particle. A highly significant (p < 0.0001) linear correlation (r = 0.956) was found between the proton relaxivity and the intensity-weighted average diameter measured by dynamic light scattering in the 19 particle systems studied. The intensity-weighted average diameter measured by dynamic light scattering is sensitive to small number fractions of larger particles/aggregates. We conclude that the primary effect leading to differences in proton relaxivity between systems arises from the small degree of aggregation within the samples, which appears to be determined by the nature of the polymer and, for one system, the degree of polymer loading of the particles. For the polyether coatings used in this study, any changes in relaxivity from differences in water exclusion or diffusion rates caused by the polymer are minor in comparison with the changes in relaxivity resulting from variations in the degree of aggregation.
Weaver, John B.; Zhang, Xiaojuan; Kuehlert, Esra; Toraya-Brown, Seiko; Reeves, Daniel B.; Perreard, Irina M.; Fiering, Steven
2013-08-01
Quantifying the number of nanoparticles present in tissue is central to many in vivo and in vitro applications. Magnetic nanoparticles can be detected with high sensitivity both in vivo and in vitro using the harmonics of their magnetization produced in a sinusoidal magnetic field. However, relaxation effects damp the magnetic harmonics rendering them of limited use in quantification. We show that an accurate measure of the number of nanoparticles can be made by correcting for relaxation effects. Correction for relaxation reduced errors of 50% for larger nanoparticles in high relaxation environments to 2%. The result is a method of nanoparticle quantification suitable for in vivo and in vitro applications including histopathology assays, quantitative imaging, drug delivery and thermal therapy preparation.
Weaver, John B.; Zhang, Xiaojuan; Kuehlert, Esra; Toraya-Brown, Seiko; Reeves, Daniel B.; Perreard, Irina M.; Fiering, Steven N.
2013-01-01
Quantifying the number of nanoparticles present in tissue is central to many in vivo and in vitro applications. Magnetic nanoparticles can be detected with high sensitivity both in vivo and in vitro using the harmonics of their magnetization produced in a sinusoidal magnetic field. However, relaxation effects damp the magnetic harmonics rendering them of limited use in quantitation. We show that an accurate measure of the number of nanoparticles can be made by correcting for relaxation effects. Correction for relaxation reduced errors of 50% for larger nanoparticles in high relaxation environments to 2%. The result is a method of nanoparticle quantitation capable of in vivo and in vitro applications including histopathology assays, quantitative imaging, drug delivery and thermal therapy preparation. PMID:23867287
A Dynamic Job Shop Scheduling Method Based on Lagrangian Relaxation
无
1999-01-01
Due to the complexity of dynamic job shop scheduling in flexible manufacturing s ystem(FMS), many heuristic rules are still used today. A dynamic scheduling appr oach based on Lagrangian relaxation is proposed to improve the quality and guara ntee the real-time capability of dynamic scheduling. The proposed method makes use of the dynamic predictive optimal theory combined with Lagrangian relaxation to obtain a good solution that can be evaluated quantitatively. The Lagrangian multipliers introduced here are capable of describing machine predictive states and system capacity constraints. This approach can evaluate the suboptimality of the scheduling systems. It can also quickly obtain high quality feasible schedu les, thus enabling Lagrangian relaxation to be better used in the dynamic schedu ling of manufacturing system. The efficiency and effectiveness of this method ar e verified by numerical experiments.
Chang, Zhiwei; Halle, Bertil
2013-10-01
In complex biological or colloidal samples, magnetic relaxation dispersion (MRD) experiments using the field-cycling technique can characterize molecular motions on time scales ranging from nanoseconds to microseconds, provided that a rigorous theory of nuclear spin relaxation is available. In gels, cross-linked proteins, and biological tissues, where an immobilized macromolecular component coexists with a mobile solvent phase, nuclear spins residing in solvent (or cosolvent) species relax predominantly via exchange-mediated orientational randomization (EMOR) of anisotropic nuclear (electric quadrupole or magnetic dipole) couplings. The physical or chemical exchange processes that dominate the MRD typically occur on a time scale of microseconds or longer, where the conventional perturbation theory of spin relaxation breaks down. There is thus a need for a more general relaxation theory. Such a theory, based on the stochastic Liouville equation (SLE) for the EMOR mechanism, is available for a single quadrupolar spin I = 1. Here, we present the corresponding theory for a dipole-coupled spin-1/2 pair. To our knowledge, this is the first treatment of dipolar MRD outside the motional-narrowing regime. Based on an analytical solution of the spatial part of the SLE, we show how the integral longitudinal relaxation rate can be computed efficiently. Both like and unlike spins, with selective or non-selective excitation, are treated. For the experimentally important dilute regime, where only a small fraction of the spin pairs are immobilized, we obtain simple analytical expressions for the auto-relaxation and cross-relaxation rates which generalize the well-known Solomon equations. These generalized results will be useful in biophysical studies, e.g., of intermittent protein dynamics. In addition, they represent a first step towards a rigorous theory of water 1H relaxation in biological tissues, which is a prerequisite for unravelling the molecular basis of soft
Relaxation Dynamics of Non-Power-Law Fluids
Min, Qi; Duan, Yuan-Yuan; Wang, Xiao-Dong; Liang, Zhan-Peng; Lee, Duu-Jong
2013-12-01
The relaxation of non-Newtonian liquids with non-power-law rheology on partially wetted surfaces is rarely investigated. This study assesses the relaxation behavior of 14 partial wetting systems with non-power-law fluids by sessile drop method. These systems are two carboxymethylcellulose sodium solutions on two kinds of slides, cover glass, and silicon wafer surfaces; three polyethylene glycol (PEG400) + silica nanoparticle suspensions on polymethyl methacrylate and polystyrene surfaces. The dynamic contact angle and moving velocity of contact line relationship data for relaxation drops of the 14 tested systems demonstrate a power-law fluid-like behavior, and the equivalent power exponent for a certain fluid on different solid substrates are uniform. By analyzing the relationship between the equivalent power exponent and shear rate, it is proposed that a fluid regime with shear rates of a few tens of s controls relaxation dynamics.
Accelerating convergence of molecular dynamics-based structural relaxation
Christensen, Asbjørn
2005-01-01
We describe strategies to accelerate the terminal stage of molecular dynamics (MD)based relaxation algorithms, where a large fraction of the computational resources are used. First, we analyze the qualitative and quantitative behavior of the QuickMin family of MD relaxation algorithms and explore...... the influence of spectral properties and dimensionality of the molecular system on the algorithm efficiency. We test two algorithms, the MinMax and Lanczos, for spectral estimation from an MD trajectory, and use this to derive a practical scheme of time step adaptation in MD relaxation algorithms to improve...
Relaxation Mechanisms in Glassy Dynamics: the Arrhenius and Fragile Regimes
Hentschel, H. George E.; Karmakar, Smarajit; Procaccia, Itamar; Zylberg, Jacques
2012-01-01
Generic glass formers exhibit at least two characteristic changes in their relaxation behavior, first to an Arrhenius-type relaxation at some characteristic temperature, and then at a lower characteristic temperature to a super-Arrhenius (fragile) behavior. We address these transitions by studying the statistics of free energy barriers for different systems at different temperatures and space dimensions. We present a clear evidence for changes in the dynamical behavior at the transition to Ar...
Protein dynamics: from rattling in a cage to structural relaxation
Khodadadia, S.; Sokolov, A.P.
2015-01-01
We present an overview of protein dynamics based mostly on results of neutron scattering, dielectric relaxation spectroscopy and molecular dynamics simulations. We identify several major classes of protein motions on the time scale from faster than picoseconds to several microseconds, and discuss th
Slow magnetic relaxation in a cobalt magnetic chain.
Yang, Chen-I; Chuang, Po-Hsiang; Lu, Kuang-Lieh
2011-04-21
A homospin ladder-like chain, [Co(Hdhq)(OAc)](n) (1; H(2)dhq = 2,3-dihydroxyquinoxaline), shows a single-chain-magnet-like (SCM-like) behavior with the characteristics of frequency dependence of the out-of-phase component in alternating current (ac) magnetic susceptibilities and hysteresis loops.
Magnetic field dependence of muon spin relaxation in geometrically frustrated Gd2Ti2O7
Dunsiger, S. R.; Kiefl, R. F.; Chakhalian, J. A.; Greedan, J. E.; Macfarlane, W. A.; Miller, R. I.; Morris, G. D.; Price, A. N.; Raju, N. P.; Sonier, J. E.
2006-05-01
Muon spin relaxation has been investigated in the geometrically frustrated antiferromagnet Gd2Ti2O7 as a function of magnetic field and temperature. Well above the magnetic ordering temperature of Tc=1K , the field dependence of the muon spin relaxation rate (T1-1) originates from field-induced changes in the spectral density of Gd fluctuations. This allows one to determine both the autocorrelation time and magnitude of the fluctuating local magnetic field at the muon. Well below Tc a coherent precession signal is observed, corresponding to a much smaller quasistatic local magnetic field. At low temperatures T1-1 levels off, at a constant value which is much larger than reported recently for a single crystal of Gd2Ti2O7 [Yaouanc , Phys. Rev. Lett. 95, 047203 (2005)]. A magnetic field of 2T completely quenches the low-temperature spin relaxation in the present sample. These results indicate that the ordered state is characterized by low-frequency dynamics which are most likely due to residual crystalline disorder.
Suppression of spin-exchange relaxation in tilted magnetic fields within the geophysical range
Scholtes, Theo; Pustelny, Szymon; Fritzsche, Stephan; Schultze, Volkmar; Stolz, Ronny; Meyer, Hans-Georg
2016-07-01
We present a detailed experimental and theoretical study on the relaxation of spin coherence due to the spin-exchange mechanism arising in the electronic ground states of alkali-metal vapor atoms. As opposed to the well-explored formation of a stretched state in a longitudinal geometry (magnetic field parallel to the laser propagation direction) we employ adapted hyperfine-selective optical pumping in order to suppress spin-exchange relaxation. By comparing measurements of the intrinsic relaxation rate of the spin coherence in the ground state of cesium atoms with detailed density-matrix simulations we show that the relaxation due to spin-exchange collisions can be reduced substantially even in a tilted magnetic field of geomagnetic strength, the major application case of scalar magnetic surveying. This explains the observed striking improvement in sensitivity and further deepens the understanding of the light-narrowed Mx magnetometer, which was presented recently. Additionally, new avenues for investigating the dynamics in alkali-metal atoms governed by the spin-exchange interaction and interacting with arbitrary external fields open up.
Relaxation dynamics of a protein solution investigated by dielectric spectroscopy.
Wolf, M; Gulich, R; Lunkenheimer, P; Loidl, A
2012-05-01
In the present work, we provide a dielectric study on two differently concentrated aqueous lysozyme solutions in the frequency range from 1MHz to 40GHz and for temperatures from 275 to 330K. We analyze the three dispersion regions, commonly found in protein solutions, usually termed β-, γ-, and δ-relaxations. The β-relaxation, occurring in the frequency range around 10MHz and the γ-relaxation around 20GHz (at room temperature) can be attributed to the rotation of the polar protein molecules in their aqueous medium and the reorientational motion of the free water molecules, respectively. The nature of the δ-relaxation, which is often ascribed to the motion of bound water molecules, is not yet fully understood. Here we provide data on the temperature dependence of the relaxation times and relaxation strengths of all three detected processes and on the dc conductivity arising from ionic charge transport. The temperature dependences of the β- and γ-relaxations are closely correlated. We found a significant temperature dependence of the dipole moment of the protein, indicating conformational changes. Moreover we find a breakdown of the Debye-Stokes-Einstein relation in this protein solution, i.e., the dc conductivity is not completely governed by the mobility of the solvent molecules. Instead it seems that the dc conductivity is closely connected to the hydration shell dynamics.
Yastremsky, I.A., E-mail: yastremsky@ukr.net
2015-05-15
The relaxation of non-equilibrium redistributions of the magnetization in a model Ni–Fe heterostructure is analyzed on the basis of the Landau–Lifshitz equation with the relaxation terms proposed by Bar'yakhtar. Bar'yakhtar‘s terms account for both the relativistic (local) and exchange (nonlocal) relaxations. It is demonstrated that the role of the nonlocal relaxation term (a spin current flowing between layers) increases for smaller systems. For nanometer-size systems the nonlocal relaxation term significantly enhances the relaxation of the Ni layer magnetization back to equilibrium. The reason of this size dependence is a competition of fast magnetization dynamics, induced by the nonlocal relaxation term near an interface between metals and slow, relativistic dynamics, which occurs at each point of the Ni–Fe heterostructure. This study provides insight in how to achieve an exceptionally fast remagnetization in magnetic heterostructures after laser excitation. - Highlights: • The relaxation of non-equilibrium spin states in a Ni–Fe heterostructure is analyzed. • Both the exchange (nonlocal) and relativistic (local) relaxations are accounted. • The nonlocal relaxation is concurrent with the creation of a spin current. • The role of the spin current increases for thinner metallic layers. • For nanometer-size systems the relaxation is primarily driven by the spin current.
Dynamics of Sulfonated Polystyrene Ionomers by Dielectric Relaxation Spectroscopy
Castagna, Alicia; Wang, Wenqin; Winey, Karen; Runt, James
2010-03-01
Broadband dielectric spectroscopy was used to investigate the dynamics of sulfonated polystyrene (SPS) ionomers, in both the acid and neutralized form. This study seeks to elucidate the role of counter ion type (Zn, Na, and Cs), degree of sulfonation (9 and 6%), and ion cluster morphology on the relaxation phenomena of SPS. Degree of neutralization and ion type have been found to significantly impact the breadth and time scale of the segmental relaxation process. High temperature relaxation processes, tentatively proposed to arise from Maxwell-Wagner-Sillars interfacial polarization and a hydrogen bonding relaxation, have also been identified. Bands in the sulfonate stretching region of FTIR spectra reveal information about ion coordination in the local aggregate environment. A combination of scanning transmission electron microscopy imaging and X-ray scattering confirmed the presence of homogeneously distributed, nearly monodisperse spherical ionic aggregates in the polymer matrix.
Jeong, Ki-Woong; Kang, Dong-Il; Lee, Eunjung; Shin, Areum; Jin, Bonghwan; Park, Young-Guen; Lee, Chung-Kyoung; Kim, Eun-Hee; Jeon, Young Ho; Kim, Eunice Eunkyeong; Kim, Yangmee
2014-07-29
Phosphatases of regenerating liver (PRLs) constitute a novel class of small, prenylated phosphatases with oncogenic activity. PRL-3 is particularly important in cancer metastasis and represents a potential therapeutic target. The flexibility of the WPD loop as well as the P-loop of protein tyrosine phosphatases is closely related to their catalytic activity. Using nuclear magnetic resonance spectroscopy, we studied the structure of vanadate-bound PRL-3, which was generated by addition of sodium orthovanadate to PRL-3. The WPD loop of free PRL-3 extended outside of the active site, forming an open conformation, whereas that of vanadate-bound PRL-3 was directed into the active site by a large movement, resulting in a closed conformation. We suggest that vanadate binding induced structural changes in the WPD loop, P-loop, helices α4-α6, and the polybasic region. Compared to free PRL-3, vanadate-bound PRL-3 has a longer α4 helix, where the catalytic R110 residue coordinates with vanadate in the active site. In addition, the hydrophobic cavity formed by helices α4-α6 with a depth of 14-15 Å can accommodate a farnesyl chain at the truncated prenylation motif of PRL-3, i.e., from R169 to M173. Conformational exchange data suggested that the WPD loop moves between open and closed conformations with a closing rate constant k(close) of 7 s(-1). This intrinsic loop flexibility of PRL-3 may be related to their catalytic rate and may play a role in substrate recognition.
Relaxation mechanisms in glassy dynamics: the Arrhenius and fragile regimes.
Hentschel, H George E; Karmakar, Smarajit; Procaccia, Itamar; Zylberg, Jacques
2012-06-01
Generic glass formers exhibit at least two characteristic changes in their relaxation behavior, first to an Arrhenius-type relaxation at some characteristic temperature and then at a lower characteristic temperature to a super-Arrhenius (fragile) behavior. We address these transitions by studying the statistics of free energy barriers for different systems at different temperatures and space dimensions. We present a clear evidence for changes in the dynamical behavior at the transition to Arrhenius and then to a super-Arrhenius behavior. A simple model is presented, based on the idea of competition between single-particle and cooperative dynamics. We argue that Arrhenius behavior can take place as long as there is enough free volume for the completion of a simple T1 relaxation process. Once free volume is absent one needs a cooperative mechanism to "collect" enough free volume. We show that this model captures all the qualitative behavior observed in simulations throughout the considered temperature range.
High-relaxivity contrast-enhanced magnetic resonance neuroimaging: a review
Giesel, Frederik L. [German Cancer Research Centre (DKFZ), Department of Radiology E010, Heidelberg (Germany); University of Heidelberg, Nuclear Medicine, Heidelberg (Germany); Mehndiratta, Amit [German Cancer Research Centre (DKFZ), Department of Radiology E010, Heidelberg (Germany); Harvard Medical School, Department of Radiology, Massachusetts General Hospital, Boston, MA (United States); Essig, Marco [German Cancer Research Centre (DKFZ), Department of Radiology E010, Heidelberg (Germany)
2010-10-15
Evaluation of brain lesions using magnetic resonance imaging (MRI) provides information that is critical for accurate diagnosis, prognosis, therapeutic intervention and monitoring response. Conventional contrast-enhanced MR neuroimaging using gadolinium (Gd) contrast agents primarily depicts disruption of the blood-brain barrier, demonstrating location and extent of disease, and also the morphological details at the lesion site. However, conventional imaging results do not always accurately predict tumour aggressiveness. Advanced functional MRI techniques such as dynamic contrast-enhanced perfusion-weighted imaging utilise contrast agents to convey physiological information regarding the haemodynamics and neoangiogenic status of the lesion that is often complementary to anatomical information obtained through conventional imaging. Most of the Gd contrast agents available have similar T1 and T2 relaxivities, and thus their contrast-enhancing capabilities are comparable. Exceptions are gadobenate-dimeglumine, Gd-EOB-DTPA, Gadobutrol and gadofosveset, which, owing to their transient-protein-binding capability, possess almost twice (and more) the T1 and T2 relaxivities as other agents at all magnetic field strengths. Numerous comparative studies have demonstrated the advantages of the increased relaxivity in terms of enhanced image contrast, image quality and diagnostic confidence. Here we summarise the benefits of higher relaxivity for the most common neuroimaging applications including MRI, perfusion-weighted imaging and MRA for evaluation of brain tumours, cerebrovascular disease and other CNS lesions. (orig.)
Relaxation dynamics in a double-well potential
Cacciari, Ilaria [Istituto di Fisica Applicata ' Nello Carrara' , C.N.R., via Madonna del Piano 10, 50019 Sesto Fiorentino, Florence (Italy)]. E-mail: i.cacciari@ifac.cnr.it; Moretti, Paolo [Istituto dei Sistemi Complessi, C.N.R., Sezione di Firenze, via Madonna del Piano 10, 50019 Sesto Fiorentino, Florence (Italy)]. E-mail: paolo.moretti@isc.cnr.it
2006-10-30
The dynamics of a two-state system subject to coherent tunneling and decay is studied using a simple quantum mechanical model, that can be applied to various physical situations. A satisfactory result, describing the behaviour of the relaxation trajectories, is obtained.
Magnetic Relaxation Study on Single Crystals of Ni4 Single-Molecule Magnets
LI Yan-Rong; LIU Hai-Qing; LIU Ying; SU Shao-Kui; WANG Yun-Ping
2009-01-01
The ac susceptibility of single crystals of Nia single-molecule magnets is measured by a compensation measurement setup. The magnetic relaxation time calculated from the peak of the out-phase component of the susceptibility fits the Arrhenius law well and gives an effective spin-flipping energy barrier of Ueff = 7.2 K. This value is far below the classical activation energy barrier of U = 14 K, whereas it is close to the energy gap between the Sz = ±4 and Sz = ±3 doublets, which indicates that quantum tunneling between the Sz ＝ 3 and Sz = -3 states plays a key role in the magnetic relaxation. Therefore the relaxation process combines thermal activation and quantum tunneling. Also we deduce that the blocking temperature of Ni4 single-molecule magnets is lower than 0.3 K by extrapolating the relaxation time plot, which ensures that this single-molecule magnet material enters a long-range magnetic ordered state instead of a spin glass state at 0.91 K.
Measurements of Brownian relaxation of magnetic nanobeads using planar Hall effect bridge sensors.
Østerberg, F W; Rizzi, G; Zardán Gómez de la Torre, T; Strömberg, M; Strømme, M; Svedlindh, P; Hansen, M F
2013-02-15
We compare measurements of the Brownian relaxation response of magnetic nanobeads in suspension using planar Hall effect sensors of cross geometry and a newly proposed bridge geometry. We find that the bridge sensor yields six times as large signals as the cross sensor, which results in a more accurate determination of the hydrodynamic size of the magnetic nanobeads. Finally, the bridge sensor has successfully been used to measure the change in dynamic magnetic response when rolling circle amplified DNA molecules are bound to the magnetic nanobeads. The change is validated by measurements performed in a commercial AC susceptometer. The presented bridge sensor is, thus, a promising component in future lab-on-a-chip biosensors for detection of clinically relevant analytes, including bacterial genomic DNA and proteins.
Field theory of bicritical and tetracritical points. II. Relaxational dynamics.
Folk, R; Holovatch, Yu; Moser, G
2008-10-01
We calculate the relaxational dynamical critical behavior of systems of O(n_||)(plus sign in circle)O(n_perpendicular) symmetry by renormalization group method within the minimal subtraction scheme in two-loop order. The three different bicritical static universality classes previously found for such systems correspond to three different dynamical universality classes within the static borderlines. The Heisenberg and the biconical fixed point lead to strong dynamic scaling whereas in the region of stability of the decoupled fixed point weak dynamic scaling holds. Due to the neighborhood of the stability border between the strong and the weak scaling dynamic fixed point to the dynamical stable fixed point a very small dynamic transient exponent of omega(Beta)_(v) =0.0044 is present in the dynamics for the physically important case n_|| =1 and n_perpendicular =2 in d=3 .
Spin Dynamics in Confined Magnetic Structures III
Hillebrands, Burkard
2006-01-01
This third volume of Spin Dynamics in Confined Magnetic Structures addresses central aspects of spin-dynamic phenomena, including recent new developments, on a tutorial level. Researchers will find a comprehensive compilation of the current work in the field. Introductory chapters help newcomers to understand the basic concepts. The more advanced chapters give the current state of the art of spin dynamic issues ranging from the femtosecond to the microsecond regime. This volume concentrates on new experimental techniques such as ferromagnetic-resonance-force microscopy and two-photon photoemission, as well as on aspects of precessional switching, spin-wave excitation, vortex dynamics, spin relaxation, domain-wall dynamics in nanowires and their applications to magnetic logic devices. An important chapter is devoted to the presently very hot subject of the spin-transfer torque, combining the physics of electronic transport and micromagnetics. The comprehensive presentation of these developments makes this volu...
Tracking ultrafast relaxation dynamics of furan by femtosecond photoelectron imaging
Liu, Yuzhu, E-mail: yuzhu.liu@gmail.com [School of Physics and Optoelectronic Engineering, Nanjing University of Information Science and Technology, Nanjing 210044 (China); Knopp, Gregor [Paul Scherrer Institute, Villigen 5232 (Switzerland); Qin, Chaochao [Department of Physics, Henan Normal University, Xinxiang 453007 (China); Gerber, Thomas [Paul Scherrer Institute, Villigen 5232 (Switzerland)
2015-01-13
Graphical abstract: - Highlights: • Relaxation dynamics of furan are tracked by femtosecond photoelectron imaging. • The mechanism for ultrafast formation of α-carbene and β-carbene is proposed. • Ultrafast internal conversion from S{sub 2} to S{sub 1} is observed. • The transient characteristics of the fragment ions are obtained. • Single-color multi-photon ionization dynamics at 800 nm are also studied. - Abstract: Ultrafast internal conversion dynamics of furan has been studied by femtosecond photoelectron imaging (PEI) coupled with photofragmentation (PF) spectroscopy. Photoelectron imaging of single-color multi-photon ionization and two-color pump–probe ionization are obtained and analyzed. Photoelectron bands are assigned to the related states. The time evolution of the photoelectron signal by pump–probe ionization can be well described by a biexponential decay: two rapid relaxation pathways with time constants of ∼15 fs and 85 (±11) fs. The rapid relaxation is ascribed to the ultrafast internal conversion (IC) from the S{sub 2} state to the vibrationally hot S{sub 1} state. The second relaxation process is attributed to the redistributions and depopulation of secondarily populated high vibronic S{sub 1} state and the formation of α-carbene and β-carbene by H immigration. Additionally, the transient characteristics of the fragment ions are also measured and discussed as a complementary understanding.
Model of THz Magnetization Dynamics
Bocklage, Lars
2016-01-01
Magnetization dynamics can be coherently controlled by THz laser excitation, which can be applied in ultrafast magnetization control and switching. Here, transient magnetization dynamics are calculated for excitation with THz magnetic field pulses. We use the ansatz of Smit and Beljers, to formulate dynamic properties of the magnetization via partial derivatives of the samples free energy density, and extend it to solve the Landau-Lifshitz-equation to obtain the THz transients of the magnetization. The model is used to determine the magnetization response to ultrafast multi- and single-cycle THz pulses. Control of the magnetization trajectory by utilizing the THz pulse shape and polarization is demonstrated. PMID:26956997
Zhang, Yue; Lynn, Alan; Gilmore, Mark; Hsu, Scott; University of New Mexico Collaboration; Los Alamos National Laboratory Collaboration
2013-10-01
A compact coaxial plasma gun is employed for experimental studies of plasma relaxation in a low density background plasma. Experiments are being conducted in the linear HelCat device at UNM. These studies will advance the knowledge of basic plasma physics in the areas of magnetic relaxation and space and astrophysical plasmas, including the evolution of active galactic jets/radio lobes within the intergalactic medium. The gun is powered by a 120pF ignitron-switched capacitor bank which is operated in a range of 5-10 kV and ~100 kA. Multiple diagnostics are employed to investigate plasma relaxation process. Magnetized Argon plasma bubbles with velocities ~1.2Cs and densities ~1020 m-3 have been achieved. Different distinct regimes of operation with qualitatively different dynamics are identified by fast CCD camera images, with the parameter determining the operation regime. Additionally, a B-dot probe array is employed to measure the spatial toroidal and poloidal magnetic flux evolution to identify detached plasma bubble configurations. Experimental data and analysis will be presented.
Molecular dynamics simulations of NMR relaxation and diffusion of bulk hydrocarbons and water
Singer, Philip M.; Asthagiri, Dilip; Chapman, Walter G.; Hirasaki, George J.
2017-04-01
Molecular dynamics (MD) simulations are used to investigate 1H nuclear magnetic resonance (NMR) relaxation and diffusion of bulk n-C5H12 to n-C17H36 hydrocarbons and bulk water. The MD simulations of the 1H NMR relaxation times T1,2 in the fast motion regime where T1 =T2 agree with measured (de-oxygenated) T2 data at ambient conditions, without any adjustable parameters in the interpretation of the simulation data. Likewise, the translational diffusion DT coefficients calculated using simulation configurations agree with measured diffusion data at ambient conditions. The agreement between the predicted and experimentally measured NMR relaxation times and diffusion coefficient also validate the forcefields used in the simulation. The molecular simulations naturally separate intramolecular from intermolecular dipole-dipole interactions helping bring new insight into the two NMR relaxation mechanisms as a function of molecular chain-length (i.e. carbon number). Comparison of the MD simulation results of the two relaxation mechanisms with traditional hard-sphere models used in interpreting NMR data reveals important limitations in the latter. With increasing chain length, there is substantial deviation in the molecular size inferred on the basis of the radius of gyration from simulation and the fitted hard-sphere radii required to rationalize the relaxation times. This deviation is characteristic of the local nature of the NMR measurement, one that is well-captured by molecular simulations.
Accelerating convergence of molecular dynamics-based structural relaxation
Christensen, Asbjørn
2005-01-01
We describe strategies to accelerate the terminal stage of molecular dynamics (MD)based relaxation algorithms, where a large fraction of the computational resources are used. First, we analyze the qualitative and quantitative behavior of the QuickMin family of MD relaxation algorithms and explore...... the influence of spectral properties and dimensionality of the molecular system on the algorithm efficiency. We test two algorithms, the MinMax and Lanczos, for spectral estimation from an MD trajectory, and use this to derive a practical scheme of time step adaptation in MD relaxation algorithms to improve...... efficiency. We also discuss the implementation aspects. Secondly, we explore the final state refinement acceleration by a combination with the conjugate gradient technique, where the key ingredient is an implicit corrector step. Finally, we test the feasibility of passive Hessian matrix accumulation from...
Revisiting the relaxation dynamics of isolated pyrrole
Montero, Raúl; Ovejas, Virginia; Fernández-Fernández, Marta; Longarte, Asier, E-mail: asier.longarte@ehu.es [Departamento de Química Física, Universidad del País Vasco (UPV/EHU), Apart. 644, 48080 Bilbao (Spain); Peralta Conde, Álvaro [Centro de Láseres Pulsados (CLPU), Edificio M3, Parque Científico, 37185 Villamayor (Spain)
2014-07-07
Herein, the interpretation of the femtosecond-scale temporal evolution of the pyrrole ion signal, after excitation in the 267–217 nm interval, recently published by our group [R. Montero, A. Peralta Conde, V. Ovejas, M. Fernández-Fernández, F. Castaño, J. R. Vázquez de Aldana, and A. Longarte, J. Chem. Phys.137, 064317 (2012)] is re-visited. The observation of a shift in the pyrrole{sup +} transient respect to zero delay reference, initially attributed to ultrafast dynamics on the πσ{sup *} type state (3s a{sub 1} ← π 1a{sub 2}), is demonstrated to be caused by the existence of pump + probe populated states, along the ionization process. The influence of these resonances in pump-prone ionization experiments, when multi-photon probes are used, and the significance of a proper zero-time reference, is discussed. The possibility of preparing the πσ{sup *} state by direct excitation is investigated by collecting 1 + 1 photoelectron spectra, at excitation wavelengths ranging from 255 to 219 nm. No conclusive evidences of ionization through this state are found.
Magnetic relaxation in a three-dimensional ferromagnet with weak quenched random-exchange disorder
S N Kaul; Anita Semwal
2003-12-01
Isothermal remanent magnetization decay, r(), and `in-ﬁeld’ growth of zero-ﬁeld-cooled magnetization, ZFC(), with time have been measured over four decades in time at temperatures ranging from 0.25 c to 1.25 c (where c is the Curie temperature, determined previously for the same sample from static critical phenomena measurements) for a nearly ordered intermetallic compound Ni3Al, which is an experimental realization of a three-dimensional (= 3) ferromagnet with weak quenched random-exchange disorder. None of the functional forms of r() predicted by the existing phenomenological models of relaxation dynamics in spin systems with quenched randomness, but only the expressions r()=0[1 \\exp(-/1)+(/2)-] and ZFC()='0[1-\\{'1\\exp(-/'1)+(/'2)-'] closely reproduce such data in the present case. The most striking features of magnetic relaxation in the system in question are as follows: Aging effects are absent in both r() and ZFC() at all temperatures in the temperature range covered in the present experiments. A cross-over in equilibrium dynamics from the one, characteristic of a pure = 3 ferromagnet with complete atomic ordering and prevalent at temperatures away from c, to that, typical of a = 3 random-exchange ferromagnet, occurs as → c. The relaxation times 1()('1()) and 2()('2()) exhibit logarithmic divergence at critical temperatures $^{_{1}}_{\\text{c}}(^{'_{1}}_{\\text{c}}(H))$ and $^{_{2}}_{\\text{c}}(^{'_{2}}_{\\text{c}}(H))$; $^{'_{1}}_{\\text{c}}$ and $^{'_{2}}_{\\text{c}}$ both increase with the external magnetic ﬁeld strength, , such that at any given ﬁeld value, $^{'_{1}}_{\\text{c}}=^{'_{2}}_{\\text{c}}$. The exponent characterizing the logarithmic divergence in $'_{1}()$ and $'_{2}()$ possesses a ﬁeld-independent value of ≃ 16 for both relaxation times. Of all the available theoretical models, the droplet ﬂuctuation model alone provides a qualitative explanation for some aspects of the present magnetic relaxation data.
Automatically Discovering Relaxed Lyapunov Functions for Polynomial Dynamical Systems
Liu, Jiang; Zhao, Hengjun
2011-01-01
The notion of Lyapunov function plays a key role in design and verification of dynamical systems, as well as hybrid and cyber-physical systems. In this paper, to analyze the asymptotic stability of a dynamical system, we generalize standard Lyapunov functions to relaxed Lyapunov functions (RLFs), by considering higher order Lie derivatives of certain functions along the system's vector field. Furthermore, we present a complete method to automatically discovering polynomial RLFs for polynomial dynamical systems (PDSs). Our method is complete in the sense that it is able to discover all polynomial RLFs by enumerating all polynomial templates for any PDS.
Relaxation Dynamics of Nanoparticle-Tethered Polymer Chains
Kim, Sung A
2015-09-08
© 2015 American Chemical Society. Relaxation dynamics of nanoparticle-tethered cis-1,4-polyisoprene (PI) are investigated using dielectric spectroscopy and rheometry. A model system composed of polymer chains densely grafted to spherical SiO
Biosensor based on measurements of the clustering dynamics of magnetic particles
2014-01-01
Disclosed herein is a biosensor for optical detection of Brownian relaxation dynamics of magnetic particles measured by light transmission. The magnetic particles can be functionalized with biological ligands for the detection of target analytes in a sample.......Disclosed herein is a biosensor for optical detection of Brownian relaxation dynamics of magnetic particles measured by light transmission. The magnetic particles can be functionalized with biological ligands for the detection of target analytes in a sample....
Measuring Cytokine Concentrations Using Magnetic Spectroscopy of Nanoparticle Brownian Relaxation
Khurshid, Hafsa; Shi, Yipeng; Weaver, John
The magnetic particle spectroscopy is a newly developed non-invasive technique for obtaining information about the nanoparticles' micro environment. In this technique the nanoparticles' magnetization, induced by an alternating magnetic field at various applied frequencies, is processed to analyze rotational freedom of nanoparticles. By analyzing average rotational freedom, it is possible to measure the nanoparticle's relaxation time, and hence get an estimate of the temperature and viscosity of the medium. In molecular concentration sensing, the rotational freedom indicates the number of nanoparticles that are bound by a selected analyte. We have developed microscopic nanoparticles probes to measure the concentration of selected molecules. The nanoparticles are targeted to bind the selected molecule and the resulting reduction in rotational freedom can be quantified remotely. Previously, sensitivity measurements has been reported to be of the factor of 200. However, with our newer perpendicular field setup (US Patent Application Serial No 61/721,378), it possible to sense cytokine concentrations as low as 5 Pico-Molar in-vitro. The excellent sensitivity of this apparatus is due to isolation of the drive field from the signal so the output can be amplified to a higher level. Dartmouth College.
Probing Brownian relaxation in water-glycerol mixtures using magnetic hyperthermia
Nemala, Humeshkar; Milgie, Michael; Wadehra, Anshu; Thakur, Jagdish; Naik, Vaman; Naik, Ratna
2013-03-01
Generation of heat by magnetic nanoparticles in the presence of an external oscillating magnetic field is known as magnetic hyperthermia (MHT). This heat is generated by two mechanisms: the Neel relaxation and Brownian relaxation. While the internal spin relaxation of the nanoparticles known as Neel relaxation is largely dependent on the magnetic properties of the nanoparticles, the physical motion of the particle or the Brownian relaxation is largely dependent on the viscous properties of the carrier liquid. The MHT properties of dextran coated iron oxide nanoparticles have been investigated at a frequency of 400KHz. To understand the influence of Brownian relaxation on heating, we probe the MHT properties of these ferrofluids in water-glycerol mixtures of varying viscosities. The heat generation is quantified using the specific absorption rate (SAR) and its maximum at a particular temperature is discussed with reference to the viscosity.
Zampetoulas, Vasileios; Lurie, David J.; Broche, Lionel M.
2017-09-01
T1 relaxation times can be measured at a range of magnetic field strengths by Fast Field-Cycling (FFC) NMR relaxometry to provide T1-dispersion curves. These are valuable tools for the investigation of material properties as they provide information about molecular dynamics non-invasively. However, accessing information at fields below 230 μT (10 kHz proton Larmor frequency) requires careful correction of unwanted environmental magnetic fields. In this work a novel method is proposed that compensates for the environmental fields on a FFC-NMR relaxometer and extends the acquisition of Nuclear Magnetic Relaxation Dispersion profiles to 2.3 μT (extremely low field region), with direct application in the study of slow molecular motions. Our method is an improvement of an existing technique, reported by Anoardo and Ferrante in 2003, which exploits the non-adiabatic behaviour of the magnetisation in rapidly-varying magnetic fields and makes use of the oscillation of the signal amplitude to estimate the field strength. This increases the accuracy in measuring the environmental fields and allows predicting the optimal correction values by applying simple equations to fit the data acquired. Validation of the method is performed by comparisons with well-known dispersion curves obtained from polymers and benzene.
Shape Dependence of Low-Temperature Magnetic Relaxation of Mn12Ac
LIU Hai-Qing; SU Shao-Kui; JING Xiu-nian; LIU Ying; LI Yan-rong; HE Lun-Hua; GE Pei-Wen; YAN Qi-Wei; WANG Yun-Ping
2008-01-01
We report the discovery that the low-temperature magnetic relaxation in Mn,12 Ac single crystals strongly depends on the shape of the samples. The relaxation time exhibits a minimum at the phase transition point between ferromagnetic and antiferromagnetic phases. The shape dependence is attributed to the dipolar interaction between molecular magnets.
Rollet, Anne-Laure; Neveu, Sophie; Porion, Patrice; Dupuis, Vincent; Cherrak, Nadine; Levitz, Pierre
2016-12-07
Relaxivities r1 and r2 of cobalt ferrite magnetic nanoparticles (MNPs) have been investigated in the aim of improving the models of NMR relaxation induced by magnetic nanoparticles. On one hand a large set of relaxivity data has been collected for cobalt ferrite MNP dispersions. On the other hand the relaxivity has been calculated for dispersions of cobalt ferrite MNPs with size ranging from 5 to 13 nm, without using any fitting procedure. The model is based on the magnetic dipolar interaction between the magnetic moments of the MNPs and the (1)H nuclei. It takes into account both the longitudinal and transversal contributions of the magnetic moments of MNPs leading to three contributions in the relaxation equations. The comparison of the experimental and theoretical data shows a good agreement of the NMR profiles as well as the temperature dependence.
Relaxation-based viscosity mapping for magnetic particle imaging
Utkur, M.; Muslu, Y.; Saritas, E. U.
2017-05-01
Magnetic particle imaging (MPI) has been shown to provide remarkable contrast for imaging applications such as angiography, stem cell tracking, and cancer imaging. Recently, there is growing interest in the functional imaging capabilities of MPI, where ‘color MPI’ techniques have explored separating different nanoparticles, which could potentially be used to distinguish nanoparticles in different states or environments. Viscosity mapping is a promising functional imaging application for MPI, as increased viscosity levels in vivo have been associated with numerous diseases such as hypertension, atherosclerosis, and cancer. In this work, we propose a viscosity mapping technique for MPI through the estimation of the relaxation time constant of the nanoparticles. Importantly, the proposed time constant estimation scheme does not require any prior information regarding the nanoparticles. We validate this method with extensive experiments in an in-house magnetic particle spectroscopy (MPS) setup at four different frequencies (between 250 Hz and 10.8 kHz) and at three different field strengths (between 5 mT and 15 mT) for viscosities ranging between 0.89 mPa · s-15.33 mPa · s. Our results demonstrate the viscosity mapping ability of MPI in the biologically relevant viscosity range.
Dispersion of T1 and T2 nuclear magnetic resonance relaxation in crude oils.
Chen, Joseph J; Hürlimann, Martin; Paulsen, Jeffrey; Freed, Denise; Mandal, Soumyajit; Song, Yi-Qiao
2014-09-15
Crude oils, which are complex mixtures of hydrocarbons, can be characterized by nuclear magnetic resonance diffusion and relaxation methods to yield physical properties and chemical compositions. In particular, the field dependence, or dispersion, of T1 relaxation can be used to investigate the presence and dynamics of asphaltenes, the large molecules primarily responsible for the high viscosity in heavy crudes. However, the T2 relaxation dispersion of crude oils, which provides additional insight when measured alongside T1, has yet to be investigated systematically. Here we present the field dependence of T1-T2 correlations of several crude oils with disparate densities. While asphaltene and resin-containing crude oils exhibit significant T1 dispersion, minimal T2 dispersion is seen in all oils. This contrasting behavior between T1 and T2 cannot result from random molecular motions, and thus, we attribute our dispersion results to highly correlated molecular dynamics in asphaltene-containing crude oils. © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.
Numerical modeling of bubble dynamics in viscoelastic media with relaxation
Warnez, M. T.; Johnsen, E.
2015-06-01
Cavitation occurs in a variety of non-Newtonian fluids and viscoelastic materials. The large-amplitude volumetric oscillations of cavitation bubbles give rise to high temperatures and pressures at collapse, as well as induce large and rapid deformation of the surroundings. In this work, we develop a comprehensive numerical framework for spherical bubble dynamics in isotropic media obeying a wide range of viscoelastic constitutive relationships. Our numerical approach solves the compressible Keller-Miksis equation with full thermal effects (inside and outside the bubble) when coupled to a highly generalized constitutive relationship (which allows Newtonian, Kelvin-Voigt, Zener, linear Maxwell, upper-convected Maxwell, Jeffreys, Oldroyd-B, Giesekus, and Phan-Thien-Tanner models). For the latter two models, partial differential equations (PDEs) must be solved in the surrounding medium; for the remaining models, we show that the PDEs can be reduced to ordinary differential equations. To solve the general constitutive PDEs, we present a Chebyshev spectral collocation method, which is robust even for violent collapse. Combining this numerical approach with theoretical analysis, we simulate bubble dynamics in various viscoelastic media to determine the impact of relaxation time, a constitutive parameter, on the associated physics. Relaxation time is found to increase bubble growth and permit rebounds driven purely by residual stresses in the surroundings. Different regimes of oscillations occur depending on the relaxation time.
Dynamical theory of spin noise and relaxation - prospects for real time NMR measurements
Field, Timothy
2014-03-01
The dynamics of a spin system is usually calculated using the density matrix. However, the usual formulation in terms of the density matrix predicts that the signal will decay to zero, and does not address the stochastic dynamics of individual spins. Spin fluctuations are to be viewed as an intrinsic quantum mechanical property of such systems immersed in random magnetic environments, and are observed as ``spin noise'' in the absence of any radio frequency (RF) excitation. Using stochastic calculus we develop a dynamical theory of spin noise and relaxation whose origins lie in the component spin fluctuations. This entails consideration of random pure states for individual protons, and how these pure states are correctly combined when the density matrix is formulated. Both the lattice and the spins are treated quantum mechanically. Such treatment incorporates both the processes of spin-spin and (finite temperature) spin-lattice relaxation. Our results reveal the intimate connections between spin noise and conventional spin relaxation, in terms of a modified spin density (MSD), distinct from the density matrix, which is necessary to describe non-ensemble averaged properties of spin systems. With the prospect of ultra-fast digitization, the role of spin noise in real time parameter extraction for (NMR) spin systems, and the advantage over standard techniques, is of essential importance, especially for systems containing a small number of spins. In this presentation we outline prospects for harnessing the recent dynamical theory in terms of spin noise measurement, with attention to real time properties.
Fang, Jiancheng; Qin, Jie
2012-10-01
The spin-exchange-relaxation-free (SERF) atomic magnetometer is an ultra-high sensitivity magnetometer, but it must be operated in a magnetic field with strength less than about 10 nT. Magnetic field compensation is an effective way to shield the magnetic field, and this paper demonstrates an in situ triaxial magnetic field compensation system for operating the SERF atomic magnetometer. The proposed hardware is based on optical pumping, which uses some part of the SERF atomic magnetometer itself, and the compensation method is implemented by analyzing the dynamics of the atomic spin. The experimental setup for this compensation system is described, and with this configuration, a residual magnetic field of strength less than 2 nT (±0.38 nT in the x axis, ±0.43 nT in the y axis, and ±1.62 nT in the z axis) has been achieved after compensation. The SERF atomic magnetometer was then used to verify that the residual triaxial magnetic fields were coincident with what were achieved by the compensation system.
Nonlinear magnetization dynamics in nanosystems
Mayergoyz, Isaak D; Serpico, Claudio
2014-01-01
As data transfer rates increase within the magnetic recording industry, improvements in device performance and reliability crucially depend on the thorough understanding of nonlinear magnetization dynamics at a sub-nanoscale level. This book offers a modern, stimulating approach to the subject of nonlinear magnetization dynamics by discussing important aspects such as the Landau-Lifshitz-Gilbert (LLG) equation, analytical solutions, and the connection between the general topological and structural aspects of dynamics. An advanced reference for the study and understanding of non
Collective Relaxation Dynamics of Small-World Networks
Grabow, Carsten; Kurths, Jürgen; Timme, Marc
2015-01-01
Complex networks exhibit a wide range of collective dynamic phenomena, including synchronization, diffusion, relaxation, and coordination processes. Their asymptotic dynamics is generically characterized by the local Jacobian, graph Laplacian or a similar linear operator. The structure of networks with regular, small-world and random connectivities are reasonably well understood, but their collective dynamical properties remain largely unknown. Here we present a two-stage mean-field theory to derive analytic expressions for network spectra. A single formula covers the spectrum from regular via small-world to strongly randomized topologies in Watts-Strogatz networks, explaining the simultaneous dependencies on network size N, average degree k and topological randomness q. We present simplified analytic predictions for the second largest and smallest eigenvalue, and numerical checks confirm our theoretical predictions for zero, small and moderate topological randomness q, including the entire small-world regime...
Excitation dynamics and relaxation in a molecular heterodimer
Balevicius, V.; Gelzinis, A. [Department of Theoretical Physics, Faculty of Physics, Vilnius University, Sauletekio Avenue 9, build. 3, LT-10222 Vilnius (Lithuania); Center for Physical Sciences and Technology, Institute of Physics, Savanoriu Avenue 231, LT-02300 Vilnius (Lithuania); Abramavicius, D. [Department of Theoretical Physics, Faculty of Physics, Vilnius University, Sauletekio Avenue 9, build. 3, LT-10222 Vilnius (Lithuania); State Key Laboratory of Supramolecular Structure and Materials, Jilin University, 2699 Qianjin Street, Changchun 130012 (China); Mancal, T. [Faculty of Mathematics and Physics, Charles University in Prague, Ke Karlovu 5, CZ-121 16 Prague 2 (Czech Republic); Valkunas, L., E-mail: leonas.valkunas@ff.vu.lt [Department of Theoretical Physics, Faculty of Physics, Vilnius University, Sauletekio Avenue 9, build. 3, LT-10222 Vilnius (Lithuania); Center for Physical Sciences and Technology, Institute of Physics, Savanoriu Avenue 231, LT-02300 Vilnius (Lithuania)
2012-08-24
Highlights: Black-Right-Pointing-Pointer Dynamics of excitation within a heterogenous molecular dimer. Black-Right-Pointing-Pointer Excited states can be swapped due to different reorganization energies of monomers. Black-Right-Pointing-Pointer Conventional excitonic basis becomes renormalized due to interaction with the bath. Black-Right-Pointing-Pointer Relaxation is independent of mutual positioning of monomeric excited states. -- Abstract: The exciton dynamics in a molecular heterodimer is studied as a function of differences in excitation and reorganization energies, asymmetry in transition dipole moments and excited state lifetimes. The heterodimer is composed of two molecules modeled as two-level systems coupled by the resonance interaction. The system-bath coupling is taken into account as a modulating factor of the molecular excitation energy gap, while the relaxation to the ground state is treated phenomenologically. Comparison of the description of the excitation dynamics modeled using either the Redfield equations (secular and full forms) or the Hierarchical quantum master equation (HQME) is demonstrated and discussed. Possible role of the dimer as an excitation quenching center in photosynthesis self-regulation is discussed. It is concluded that the system-bath interaction rather than the excitonic effect determines the excitation quenching ability of such a dimer.
Multi-exponential inversions of nuclear magnetic resonance relaxation signal
WANG; Weimin(
2001-01-01
［1］Kenyon, W. E. , Petrophysical principles of applications of NMR logging, The Log Analyst, 1997, March-April: 21－43.［2］Timur, A., Producible porosity and permeability of sandstone investigated through nuclear magnetic resonance principles,Journal of Petroleum Technology, 1969, 21: 775－786.［3］Chakrabarty, T. , Longo, J. , A new method for mineral quantification to aid in hydrocarbon exploration and exploitation,Journal of Canadian Petroleum Technology, 1997, 36(11 ): 15－21.［4］Kleinberg, R. L. , Vinegar, H. J. , NMR properties of reservoir fluids, The Log Analyst, 1996, November-December: 20－32.［5］Wahba, G. , Practical approximate solutions to linear operator equations when the data are noisy, SIAM. J. Numer. Anal. ,1977, 14(4): 651－667.［6］Butler, J. P. , Reeds, J. A. , Dawson, S. V. , Estimating solutions of first kind integral equations with nonnegative constraints and optimal smoothing, SIAM J. Numer. Anal. , 1981, 18(3): 381－397.［7］Munn, K. , Smith, D. M., A NMR technique for the analysis of pore structure: Numerical inversion of relaxation measurements, Journal of Colloid and Interface Science, 1987,19(1): 117－126.［8］Provencher, S. W., A constrained regularization method for inverting data represented by linear algebraic or integral equations, Computer Physics Communications, 1982, 27: 213－227.［9］Bergman, D. J., Dunn, K. J., Magnetic susceptibility contrasted fixed field gradient effects on the spin-echo amplitude in a periodic porous media with diffusion, Phys. Soc., 1995, 40: 695－702.［10］Wang Weimin, The basic experiment studies of NMR logging, Well Logging Technology, 1997, 21 (6): 385－392.
Electronic field free line rotation and relaxation deconvolution in magnetic particle imaging.
Bente, Klaas; Weber, Matthias; Graeser, Matthias; Sattel, Timo F; Erbe, Marlitt; Buzug, Thorsten M
2015-02-01
It has been shown that magnetic particle imaging (MPI), an imaging method suggested in 2005, is capable of measuring the spatial distribution of magnetic nanoparticles. Since the particles can be administered as biocompatible suspensions, this method promises to perform well as a tracer-based medical imaging technique. It is capable of generating real-time images, which will be useful in interventional procedures, without utilizing any harmful radiation. To obtain a signal from the administered superparamagnetic iron oxide (SPIO) particles, a sinusoidal changing external homogeneous magnetic field is applied. To achieve spatial encoding, a gradient field is superimposed. Conventional MPI works with a spatial encoding field that features a field free point (FFP). To increase sensitivity, an improved spatial encoding field, featuring a field free line (FFL) can be used. Previous FFL scanners, featuring a 1-D excitation, could demonstrate the feasibility of the FFL-based MPI imaging process. In this work, an FFL-based MPI scanner is presented that features a 2-D excitation field and, for the first time, an electronic rotation of the spatial encoding field. Furthermore, the role of relaxation effects in MPI is starting to move to the center of interest. Nevertheless, no reconstruction schemes presented thus far include a dynamical particle model for image reconstruction. A first application of a model that accounts for relaxation effects in the reconstruction of MPI images is presented here in the form of a simplified, but well performing strategy for signal deconvolution. The results demonstrate the high impact of relaxation deconvolution on the MPI imaging process.
Universal nonexponential relaxation: Complex dynamics in simple liquids.
Turton, David A; Wynne, Klaas
2009-11-28
The dynamics of the noble-gas liquids underlies that of all liquids making them an important prototypical model system. Using optical Kerr-effect spectroscopy we show that for argon, krypton, and xenon, both the librational and diffusional contributions to the spectrum are surprisingly complex. The diffusional relaxation appears as a stretched-exponential, such as widely found in studies of structured (e.g., glass-forming) liquids and as predicted by mode-coupling theory. We show that this behavior is remarkably similar to that measured in water and suggest that it is a fundamental or universal property.
Magnetic relaxation in Zn(PO{sub 3}){sub 2}·Er(PO{sub 3}){sub 3} glass
Orendáč, M. [Institute of Physics, P.J. Šafárik University, Park Angelinum 9, 041 54 Košice (Slovakia); Tibenská, K. [Faculty of Aeronautics, Technical University, Rampová 7, 041 21 Košice (Slovakia); Čižmár, E.; Tkáč, V.; Orendáčová, A. [Institute of Physics, P.J. Šafárik University, Park Angelinum 9, 041 54 Košice (Slovakia); Holubová, J. [University of Pardubice, Faculty of Chemical Technology, Department of General and Inorganic Chemistry, Studentská 573, Pardubice 53210 (Czech Republic); Černošek, Z. [Institute of Physics, P.J. Šafárik University, Park Angelinum 9, 041 54 Košice (Slovakia); Faculty of Aeronautics, Technical University, Rampová 7, 041 21 Košice (Slovakia); University of Pardubice, Faculty of Chemical Technology, Department of General and Inorganic Chemistry, Studentská 573, Pardubice 53210 (Czech Republic); and others
2016-08-15
The results of experimental studies of alternating (ac) magnetic susceptibility and specific heat of Zn(PO{sub 3}){sub 2}·Er(PO{sub 3}){sub 3} glass are reported. Despite a high concentration of magnetic Er(III) ions the analysis of ac susceptibility ruled out the formation of a spin glass state in the used range of temperatures. Two relaxation processes were identified. The first one is thermally activated with a crossover in its temperature dependence observed at nominally 7 K. The relaxation at lower temperatures seems to be governed by a direct process with pronounced effect of phonon bottleneck. Striking deceleration of spin dynamics with increasing temperature found above 7 K is tentatively attributed to overcoming Ioffe – Regel crossover and strong scattering of acoustic phonons on local modes. Simplified prediction derived from a soft-mode-dynamics model confirms the presence of the boson peak observed in specific heat data and reasonably predicts the temperature of the crossover. The second process is consistent with a cross – tunneling relaxation. The obtained results suggest that magnetic doping of glasses and studying magnetic relaxation may represent an alternative tool for the investigation of lattice modes in glasses. - Highlights: • The boson peak in Zn(PO{sub 3}){sub 2}·Er(PO{sub 3}){sub 3} glass appears at temperatures, at which localized modes are thermally excited. • The formation of the boson peak is accompanied by anomalous slowing of the magnetic relaxation in Zn(PO{sub 3}){sub 2}·Er(PO{sub 3}){sub 3}.
Dynamic Assembly of Magnetic Colloidal Vortices
Mohorič, Tomaž; Kokot, Gašper; Osterman, Natan; Snezhko, Alexey; Vilfan, Andrej; Babič, Dušan; Dobnikar, Jure
2016-04-29
Magnetic colloids in external time-dependent fields are subject to complex induced many-body interactions governing their self-assembly into a variety of equilibrium and out-of-equilibrium structures such as chains, networks, suspended membranes, and colloidal foams. Here, we report experiments, simulations, and theory probing the dynamic assembly of superparamagnetic colloids in precessing external magnetic fields. Within a range of field frequencies, we observe dynamic large-scale structures such as ordered phases composed of precessing chains, ribbons, and rotating fluidic vortices. We show that the structure formation is inherently coupled to the buildup of torque, which originates from internal relaxation of induced dipoles and from transient correlations among the particles as a result of short-lived chain formation. We discuss in detail the physical properties of the vortex phase and demonstrate its potential in particle-coating applications.
Dynamic nuclear polarization and relaxation of H and D atoms in solid mixtures of hydrogen isotopes
Sheludiakov, S; Järvinen, J; Vainio, O; Lehtonen, L; Vasiliev, S; Lee, D M; Khmelenko, V V
2016-01-01
We report on a study of Dynamic Nuclear Polarization and electron and nuclear spin relaxation of atomic hydrogen and deuterium in solid molecular matrices of H$_{2}$, D$_{2}$, and HD mixtures. The electron and nuclear spin relaxation times ($T_{1e}$ and $T_{1N}$) were measured within the temperature range 0.15-2.5$\\,$K in a magnetic field of 4.6 T, conditions which ensure a high polarization of electron spins. We found that $T_{1e}$ is nearly temperature independent in this temperature range, while $T_{1N}$ decreased by 2 orders of magnitude. Such strong temperature dependence is typical for the nuclear Orbach mechanism of relaxation via the electron spins. We found that the nuclear spins of H atoms in solid D$_{2}$ and D$_{2}:$HD can be efficiently polarized by the Overhauser effect. Pumping the forbidden transitions of H atoms also leads to DNP, with the efficiency strongly dependent on the concentration of D atoms. This behaviour indicates the Cross effect mechanism of the DNP and nuclear relaxation, which...
Anisotropy dependent magnetization relaxation in (Cd,Mn)Te quantum wells
Goryca, M.; Nawrocki, M. [Institute of Experimental Physics, Warsaw University, Hoza 69, 00-681 Warsaw (Poland); Kossacki, P.; Pacuski, W.; Maslana, W. [Institute of Experimental Physics, Warsaw University, Hoza 69, 00-681 Warsaw (Poland); Joined Group Nanophysique et Semiconducteurs, CNRS/CEA/ Universite Joseph Fourier Grenoble, BP 87, 38402 Saint Martin d' Heres cedex (France); Ferrand, D.; Tatarenko, S. [Joined Group Nanophysique et Semiconducteurs, CNRS/CEA/ Universite Joseph Fourier Grenoble, BP 87, 38402 Saint Martin d' Heres cedex (France); Cibert, J. [Laboratoire Louis Neel, CNRS, BP166, 38042 Grenoble cedex 9 (France)
2006-07-01
An optical study of magnetization relaxation is presented for p-doped quantum wells with magnetic ions. The magnetic anisotropy of the system is controlled by the heavy-light hole splitting, tuned by uniaxial strain. We show that a suppression of the magnetic anisotropy results in an enhancement of the observed relaxation rate by a factor of at least 20. This is explained by the fact that the decrease of the anisotropy results in the lowering of the energy barrier for the domain magnetization flip process. (copyright 2006 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)
Magnetic relaxation effects in zero field cooled Y-Ba-Cu-O
Hasanain, S.K.; Mumtaz, A.; Ali, T.; Husain, M.; Bhatti, G.S. (Dept. of Physics, Quaid-i-Azam Univ., Islamabad (PK))
1990-03-10
This paper reports on results of the magnetic relaxation in 1:2:3 superconductors initiated by a very slow field reversal. The authors find that the relaxation at earlier times follows a stretched exponential type function, while at longer times it has a logarithmic behavior. The onset time of lnt behavior depends on the applied field. The data is interpreted in terms of a two-stage relaxation process.
Mondal, Ritwik; Berritta, Marco; Oppeneer, Peter M.
2016-10-01
Starting from the Dirac-Kohn-Sham equation, we derive the relativistic equation of motion of spin angular momentum in a magnetic solid under an external electromagnetic field. This equation of motion can be rewritten in the form of the well-known Landau-Lifshitz-Gilbert equation for a harmonic external magnetic field and leads to a more general magnetization dynamics equation for a general time-dependent magnetic field. In both cases there is an electronic spin-relaxation term which stems from the spin-orbit interaction. We thus rigorously derive, from fundamental principles, a general expression for the anisotropic damping tensor which is shown to contain an isotropic Gilbert contribution as well as an anisotropic Ising-like and a chiral, Dzyaloshinskii-Moriya-like contribution. The expression for the spin relaxation tensor comprises furthermore both electronic interband and intraband transitions. We also show that when the externally applied electromagnetic field possesses spin angular momentum, this will lead to an optical spin torque exerted on the spin moment.
Excitation Dynamics and Relaxation in a Molecular Heterodimer
Balevicius, V; Abramavicius, D; Mancal, T; Valkunas, L
2011-01-01
The exciton dynamics in a molecular heterodimer is studied as a function of differences in excitation and reorganization energies, asymmetry in transition dipole moments and excited state lifetimes. The heterodimer is composed of two molecules modeled as two-level systems coupled by the resonance interaction. The system-bath coupling is taken into account as a modulating factor of the energy gap of the molecular excitation, while the relaxation to the ground state is treated phenomenologically. Comparison of the description of the excitation dynamics modeled using either the Redfield equations (secular and full forms) or the Hierarchical quantum master equation (HQME) is demonstrated and discussed. Possible role of the dimer as an excitation quenching center in photosynthesis self-regulation is discussed. It is concluded that the system-bath interaction rather than the excitonic effect determines the excitation quenching ability of such a dimer.
Jeletic, Matthew; Lin, Po-Heng; Le Roy, Jennifer J; Korobkov, Ilia; Gorelsky, Serge I; Murugesu, Muralee
2011-12-07
A dysprosium(III) sandwich complex, [Dy(III)(COT″)(2)Li(THF)(DME)], was synthesized using 1,4-bis(trimethylsilyl)cyclooctatetraenyl dianion (COT″). The complex behaves as a single-ion magnet and demonstrates unusual multiple relaxation modes. The observed relaxation pathways strongly depend on the applied static dc fields.
Evaluation of relaxation time measurements by magnetic resonance imaging. A phantom study
Kjaer, L; Thomsen, C; Henriksen, O
1987-01-01
Several circumstances may explain the great variation in reported proton T1 and T2 relaxation times usually seen. This study was designed to evaluate the accuracy of relaxation time measurements by magnetic resonance imaging (MRI) operating at 1.5 tesla. Using a phantom of nine boxes with different...
Kuznetsov, Anatoly A.; Filippov, Victor I.; Alyautdin, Renat N.; Torshina, N.L.; Kuznetsov, O.A. E-mail: oleg@louisiana.edu
2001-07-01
Magnetic liposomes containing submicron-sized ferromagnetic particles were prepared encapsulating the muscle relaxant drugs, diadony or diperony, for local anesthesia. Alternatively, metal phthalocyanines (Photosense or Teraphthal), sensitizers for photodynamic or catalytic cancer therapy were loaded into the magnetic liposomes. Animal trials demonstrated successful magnetically guided transport of the drug-loaded liposomes.
Jedlovszky-Hajdu, Angela, E-mail: angela.hajdu@net.sote.hu [Laboratory of Nanochemistry, Department of Biophysics and Radiation Biology, Semmelweis University, Nagyvarad Sq 4, H-1089 Budapest (Hungary); Tombacz, Etelka, E-mail: tombacz@chem.u-szeged.hu [Department of Physical Chemistry and Material Science, University of Szeged, Aradi Vt. Sq 1, Szeged 6720 (Hungary); Banyai, Istvan, E-mail: banyai.istvan@science.unideb.hu [Department of Colloid and Environmental Chemistry, University of Debrecen (Hungary); Babos, Magor, E-mail: babosmagor@yahoo.com [Euromedic Diagnostics Szeged Ltd., Semmelweis St 6, Szeged 6720 (Hungary); Palko, Andras, E-mail: palko@radio.szote.u-szeged.hu [Faculty of Medicine, Department of Radiology, University of Szeged (Hungary)
2012-09-15
At the moment the biomedical applications of magnetic fluids are the subject of intensive scientific interest. In the present work, magnetite nanoparticles (MNPs) were synthesized and stabilized in aqueous medium with different carboxylic compounds (citric acid (CA), polyacrylic acid (PAA), and sodium oleate (NaOA)), in order to prepare well stabilized magnetic fluids (MFs). The magnetic nanoparticles can be used in the magnetic resonance imaging (MRI) as contrast agents. Magnetic resonance relaxation measurements of the above MFs were performed at different field strengths (i.e., 0.47, 1.5 and 9.4 T) to reveal the field strength dependence of their magnetic responses, and to compare them with that of ferucarbotran, a well-known superparamagnetic contrast agent. The measurements showed characteristic differences between the tested magnetic fluids stabilized by carboxylic compounds and ferucarbotran. It is worthy of note that our magnetic fluids have the highest r2 relaxivities at the field strength of 1.5 T, where the most of the MRI works in worldwide. - Highlights: Black-Right-Pointing-Pointer Magnetic resonance relaxation measurements were done at different field strengths. Black-Right-Pointing-Pointer Results show characteristic differences between the tested carboxylated MFs. Black-Right-Pointing-Pointer r1 and r2 relaxivities depend on the thickness of the protecting layer. Black-Right-Pointing-Pointer MFs have high r2/r1 ratios at each magnetic field.
Lefkidis, G.; Sold, S.; Hübner, W.
2017-06-01
We study an s-p model magnetic system with a triplet ground state coupled to two temperature baths. By varying the temperatures we both generate non-thermal electronic distributions and create additional coherences in the density matrix of the system. Thus the thermally-induced magnetic response goes beyond the simple picture of majority-minority population dynamics. Furthermore, we discuss the influence of temperature induced relaxation effects on the dynamics induced by an optical perturbation for this quantum system.
Reliable Approximation of Long Relaxation Timescales in Molecular Dynamics
Wei Zhang
2017-07-01
Full Text Available Many interesting rare events in molecular systems, like ligand association, protein folding or conformational changes, occur on timescales that often are not accessible by direct numerical simulation. Therefore, rare event approximation approaches like interface sampling, Markov state model building, or advanced reaction coordinate-based free energy estimation have attracted huge attention recently. In this article we analyze the reliability of such approaches. How precise is an estimate of long relaxation timescales of molecular systems resulting from various forms of rare event approximation methods? Our results give a theoretical answer to this question by relating it with the transfer operator approach to molecular dynamics. By doing so we also allow for understanding deep connections between the different approaches.
Multiscale Dynamics of Solar Magnetic Structures
Uritsky, Vadim M.; Davila, Joseph M.
2012-01-01
Multiscale topological complexity of the solar magnetic field is among the primary factors controlling energy release in the corona, including associated processes in the photospheric and chromospheric boundaries.We present a new approach for analyzing multiscale behavior of the photospheric magnetic flux underlying these dynamics as depicted by a sequence of high-resolution solar magnetograms. The approach involves two basic processing steps: (1) identification of timing and location of magnetic flux origin and demise events (as defined by DeForest et al.) by tracking spatiotemporal evolution of unipolar and bipolar photospheric regions, and (2) analysis of collective behavior of the detected magnetic events using a generalized version of the Grassberger-Procaccia correlation integral algorithm. The scale-free nature of the developed algorithms makes it possible to characterize the dynamics of the photospheric network across a wide range of distances and relaxation times. Three types of photospheric conditions are considered to test the method: a quiet photosphere, a solar active region (NOAA 10365) in a quiescent non-flaring state, and the same active region during a period of M-class flares. The results obtained show (1) the presence of a topologically complex asymmetrically fragmented magnetic network in the quiet photosphere driven by meso- and supergranulation, (2) the formation of non-potential magnetic structures with complex polarity separation lines inside the active region, and (3) statistical signatures of canceling bipolar magnetic structures coinciding with flaring activity in the active region. Each of these effects can represent an unstable magnetic configuration acting as an energy source for coronal dissipation and heating.
Phase transitions and relaxation dynamics of Ising models exchanging particles
Goh, Segun; Fortin, Jean-Yves; Choi, M. Y.
2017-01-01
A variety of systems in nature and in society are open and subject to exchanging their constituents with other systems (e.g., environments). For instance, in biological systems, cells collect necessary energy and material by exchange of molecules or ions. Similarly, countries, cities or research institutes evolve as their constituents move in or out. To probe the corresponding particle exchange dynamics in such systems, we consider two Ising models exchanging particles and establish a master equation describing the equilibrium phases as well as the non-equilibrium dynamics of the system. It is found that an additional stable phase emerges as a consequence of the particle exchange process. Furthermore, we formulate the Ginzburg-Landau theory which allows to probe correlation effects. Accordingly, critical slowing down is manifested and the associated dynamic exponent is computed in the linear relaxation regime. In particular, this approach is relevant for investigating the grand canonical description of the system plus environment, with particle exchange and state transitions taken into account explicitly.
Nuclear relaxation in an electric field enables the determination of isotropic magnetic shielding
Garbacz, Piotr
2016-08-01
It is shown that in contrast to the case of nuclear relaxation in a magnetic field B, simultaneous application of the magnetic field B and an additional electric field E causes transverse relaxation of a spin-1/2 nucleus with the rate proportional to the square of the isotropic part of the magnetic shielding tensor. This effect can contribute noticeably to the transverse relaxation rate of heavy nuclei in molecules that possess permanent electric dipole moments. Relativistic quantum mechanical computations indicate that for 205Tl nucleus in a Pt-Tl bonded complex, Pt(CN)5Tl, the transverse relaxation rate induced by the electric field is of the order of 1 s-1 at E = 5 kV/mm and B = 10 T.
Ahmadi R.
2012-01-01
Full Text Available In this work, a new approach is described for the calculation of the relaxation time and magnetic anisotropy energy of magnetic nanoparticles. Ferrofluids containing monodispersed magnetite nanoparticles were synthesized via hydrothermal method and then heated using the 10 kA/m external AC magnetic fields in three different frequencies: 10, 50 and 100 kHz. By measuring the temperature variations during the application of the magnetic field, the total magnetic time constant including both Brownian and Neel relaxation times can be calculated. By measuring the magnetic core size and hydrodynamic size of particles, the magnetic anisotropy can be calculated too. Synthesized ferrofluids were characterized via TEM, XRD, VSM and PCS techniques and the results were used for the mentioned calculations.
Sappey, R. E-mail: sappey@physics.ucsd.edu; Vincent, E.; Ocio, M.; Hammann, J
2000-11-01
We discuss here the nature of the low-temperature magnetic relaxation in samples of magnetic nanoparticles. In addition to usual magnetic viscosity measurement, we have used the residual memory ratio (RMR) method. This procedure enables us to overcome the uncertainties usually associated with the energy barrier distribution, thus giving a more detailed insight on the nature of the observed dynamics. A custom-made apparatus coupling dilution refrigeration and SQUID magnetometry allowed measurements of very diluted samples at temperatures ranging between 60 mK and 7 K. Two types of particles have been studied: {gamma}-Fe{sub 2}O{sub 3} of moderate anisotropy, and CoFe{sub 2}O{sub 4} of higher anisotropy where quantum effects are more likely to occur. In both cases, the data cannot simply be interpreted in terms of mere thermally activated dynamics of independent particles. The deviation from thermal activation seems to go opposite of what is expected from the possible effect of particle interactions. We therefore believe that it suggests the occurrence of quantum dynamics at very low temperatures.
Zero-field slow magnetic relaxation in a uranium(III) complex with a radical ligand.
Coutinho, Joana T; Antunes, Maria A; Pereira, Laura C J; Marçalo, Joaquim; Almeida, Manuel
2014-09-14
[U(Tp(Me2))2(bipy˙)], a uranium(III) complex with a radical bipyridine ligand which has magnetic properties with contributions from both the ligand and the metal, presents slow relaxation of the magnetisation at low temperatures, already under zero static magnetic field, and energy barriers slightly above the non-radical analogues.
Magnetic relaxation behaviour in Pr{sub 2}NiSi{sub 3}
Pakhira, Santanu, E-mail: santanupakhira20006@gmail.com; Mazumdar, Chandan; Ranganathan, R. [Condensed Matter Physics Division, Saha Institute Of Nuclear Physics, 1/AF Bidhannagar, Kolkata-700064 (India)
2016-05-06
Time dependent isothemal remanent magnetizatin (IRM) behaviour for polycrystalline compound Pr{sub 2}NiSi{sub 3} have been studied below its characteristic temperature. The compound undergoes slow magnetic relaxation with time. Along with competing interaction, non-magnetic atom disorder plays an important role in formation of non-equilibrium glassy like ground state for this compound.
Carroll, Matthew R J; Huffstetler, Phillip P; Miles, William C; Goff, Jonathon D; Davis, Richey M; Riffle, Judy S; House, Michael J; Woodward, Robert C; St Pierre, Timothy G
2011-08-12
Iron oxide magnetic nanoparticles are good candidates for magnetic resonance imaging (MRI) contrast agents due to their high magnetic susceptibilities. Here we investigate 19 polyether-coated magnetite nanoparticle systems comprising three series. All systems were synthesized from the same batch of magnetite nanoparticles. A different polyether was used for each series. Each series comprised systems with systematically varied polyether loadings per particle. A highly significant (p coatings used in this study, any changes in relaxivity from differences in water exclusion or diffusion rates caused by the polymer are minor in comparison with the changes in relaxivity resulting from variations in the degree of aggregation.
A method to simulate multilayer welding process: Node dynamic relaxation method
Gao Jiashuang; Yang Jianguo; Fang Hongyuan; Hu Junfeng; Wang Tao
2009-01-01
A new method called node dynamic relaxation is proposed to simulate multilayer welding. A two dimensional plane strain model for multilayer welding is simulated and the results show that mesh distortion can be decreased, and it is also found that the node dynamic relaxation is a kind of method to calculate welding deformation accurately by comparing experiment results with simulation results.
On-chip Brownian relaxation measurements of magnetic nanobeads in the time domain
Østerberg, Frederik Westergaard; Rizzi, Giovanni; Hansen, Mikkel Fougt
2013-01-01
magnetic fields are needed. First, the method is demonstrated on Brownian relaxation measurements of beads with nominal sizes of 40, 80, 130, and 250 nm. The results are found to compare well to those obtained by an already established measurement technique in the frequency domain. Next, we demonstrate......We present and demonstrate a new method for on-chip Brownian relaxation measurements on magnetic nanobeads in the time domain using magnetoresistive sensors. The beads are being magnetized by the sensor self-field arising from the bias current passed through the sensors and thus no external...... the time and frequency domain methods on Brownian relaxation detection of clustering of streptavidin coated magnetic beads in the presence of different concentrations of biotin-conjugated bovine serum albumin and obtain comparable results. In the time domain, a measurement is carried out in less than 30 s...
Multi-exponential inversions of nuclear magnetic resonance relaxation signal
王为民; 叶朝辉; 李培
2001-01-01
Beginning from the first kind of integral equation, two kinds of methods, i. e. Singular Value Decomposition (SVD) and transform that are fit for the inversion calculation of NMR multi-relaxation data from rock, have been derived. The mathematical processing was discussed in detail. The advantage and disadvantage of the two methods have been compared in theory and application. From the view of the degree of freedom of the inversion solution, we discussed the resolution of the solution of NMR relaxation inversion and the selection of optimal inversion modeling. Results showed that SVD method is fit for the inversion of NMR relaxation data with a higher signal to noise ratio and transform inversion method is more flexible and can be used in NMR data with a lower signal to noise ratio. It is advisable that transform inversion method be selected for the multi-relaxation inversion of rock NMR data. SVD method can be used when the signal to noise ratio is better than 80. In order to ensure the accuracy, the number of T2 points should be varied from 30 to 50. The results of the research are useful for NMR core analysis and the interpretation of NMR logging data.
Nuclear magnetic relaxation studies of semiconductor nanocrystals and solids
Sachleben, J. R. [Lawrence Berkeley Lab., CA (United States); California Univ., Berkeley, CA (United States). Dept. of Chemistry
1993-09-01
Semiconductor nanocrystals, small biomolecules, and {sup 13}C enriched solids were studied through the relaxation in NMR spectra. Surface structure of semiconductor nanocrystals (CdS) was deduced from high resolution {sup 1}H and {sup 13}C liquid state spectra of thiophenol ligands on the nanocrystal surfaces. The surface coverage by thiophenol was found to be low, being 5.6 and 26% for nanocrystal radii of 11.8 and 19.2 {angstrom}. Internal motion is estimated to be slow with a correlation time > 10{sup {minus}8} s{sup {minus}1}. The surface thiophenol ligands react to form a dithiophenol when the nanocrystals were subjected to O{sub 2} and ultraviolet. A method for measuring {sup 14}N-{sup 1}H J-couplings is demonstrated on pyridine and the peptide oxytocin; selective 2D T{sub 1} and T{sub 2} experiments are presented for measuring relaxation times in crowded spectra with overlapping peaks in 1D, but relaxation effects interfere. Possibility of carbon-carbon cross relaxation in {sup 13}C enriched solids is demonstrated by experiments on zinc acetate and L-alanine.
Martínez-Santiesteban, Francisco M; Dang, Thien Phuoc; Lim, Heeseung; Chen, Albert P; Scholl, Timothy J
2017-09-01
In vivo pH mapping in tissue using hyperpolarized hydrogencarbonate-(13) C has been proposed as a method to study tumor growth and treatment and other pathological conditions related to pH changes. The finite spin-lattice relaxation times (T1 ) of hyperpolarized media are a significant limiting factor for in vivo imaging. Relaxation times can be measured at standard magnetic fields (1.5 T, 3.0 T etc.), but no such data are available at low fields, where T1 values can be significantly shorter. This information is required to determine the potential loss of polarization as the agent is dispensed and transported from the polarizer to the MRI scanner. The purpose of this study is to measure T1 dispersion from low to clinical magnetic fields (0.4 mT to 3.0 T) of different hyperpolarized hydrogencarbonate formulations previously proposed in the literature for in vivo pH measurements. (13) C-enriched cesium and sodium hydrogencarbonate preparations were hyperpolarized using dynamic nuclear polarization, and the T1 values of different samples were measured at different magnetic field strengths using a fast field-cycling relaxometer and a 3.0 T clinical MRI system. The effects of deuterium oxide as a dissolution medium for sodium hydrogencarbonate were also analyzed. This study finds that the cesium formulation has slightly shorter T1 values compared with the sodium preparation. However, the higher solubility of cesium hydrogencarbonate-(13) C means it can be polarized at greater concentration, using less trityl radical than sodium hydrogencarbonate-(13) C. This study also establishes that the preparation and handling of sodium hydrogencarbonate formulations in relation to cesium hydrogencarbonate is more difficult, due to the higher viscosity and lower achievable concentrations, and that deuterium oxide significantly increases the T1 of sodium hydrogencarbonate solutions. Finally, this work also investigates the influence of pH on the spin-lattice relaxation of cesium
Relaxation time diagram for identifying heat generation mechanisms in magnetic fluid hyperthermia
Lima, Enio, E-mail: lima@cab.cnea.gov.ar; De Biasi, Emilio; Zysler, Roberto D.; Vasquez Mansilla, Marcelo; Mojica-Pisciotti, Mary L. [Centro Atómico Bariloche/CONICET (Argentina); Torres, Teobaldo E.; Calatayud, M. Pilar; Marquina, C.; Ricardo Ibarra, M.; Goya, Gerardo F. [Universidad de Zaragoza, Instituto de Nanociencia de Aragón INA (Spain)
2014-12-15
We present a versatile diagram to envisage the dominant relaxation mechanism of single-domain magnetic nanoparticles (MNPs) under alternating magnetic fields, as those used in magnetic fluid hyperthermia (MFH). The diagram allows estimating the heating efficiency, measured by the Specific Power Absorption (SPA), originated in the magnetic and viscous relaxation times of single-domain MNPs for a given frequency of the ac magnetic field (AFM). The diagram has been successfully applied to different colloids, covering a wide variety of MNPs with different magnetic anisotropy and particle size, and dispersed in different viscous liquid carriers. From the general diagram, we derived a specific chart based on the Linear Response Theory in order to easily estimate the experimental condition for the optimal SPA values of most colloids currently used in MFH.
Violent Relaxation, Dynamical Instabilities and the Formation of Elliptical Galaxies
Aguilar, L. A.
1990-11-01
RESUMEN: El problema de la formaci6n de galaxias elfpticas por medjo de colapso gravitacional sin disipaci6n de energfa es estudiado usando un gran numero de simulaciones numericas. Se muestra que este tipo de colapsos, partiendo de condiciones iniciales frfas donde la energfa cinetica inicial representa s6lo un 5%, 0 , de a potencial inicial, produce sistemas relajados de forma triaxial muy similares a las galaxias elfpticas reales en sus formas y perfiles de densidad en proyecci6i . La forina triaxial resulta de la acci6n de una inestabilidad dinamica que aparece en sistemas 'inicos dominados por movimientos radiales, mientras que el perfil de densidad final Cs debido al llamado relajamiento violento que tiende a producir una distribuci6n en espacio fase unica. Estos dos fen6menos tienden a borrar los detalles particulares sobre las condiciones iniciales y dan lugar a una evoluci6n convergente hacia sistemas realistas, esto innecesario el uso de condiciones iniciales especiales (excepto por Ia condici6i de que estas deben ser frfas). Las condiciones iniciales frfas producen los movimientos radiales y fluctuaciones de la energfa potencial requeridos por ambos fen6menos. ABSTRACT: The problem of formation of elliptical galaxies via dissipationless collapse is studied using a large set of numerical simulations. It is shown that dissipationless collapses from cold initial conditions, where the total initial kinetic energy is less than 5% ofthe initial potential energy, lead to relaxed triaxial systems ery similar to real elliptical galaxies ii projected shape and density profiles. The triaxial shape is due to the of a dynamical instability that appears on systems dominated by radial orbits, while final density profile is due to violent relaxation that tends to produce a unique distribution iii space. These two phenomena erase memory of the initial prodtice a convergent evolution toward realistic systems, thus making unnecessary use o[special initial conditions (other
Magnetic dynamics of ferrofluids: mathematical models and experimental investigations
Wu, Kai; Tu, Liang; Su, Diqing; Wang, Jian-Ping
2017-03-01
Magnetite ferrofluids with unique magnetic behaviors are attractive for biomedical applications such as magnetic fluid hyperthermia and magnetic particle imaging. A precise nanoparticle-specific characterization by theoretical models and experiments to predict dynamics of ferrofluids and optimize their behaviors for emerging biomedical applications is necessary. In this paper, combining experiments and modeling, we have uncovered interesting magnetic dynamics of nanoparticles that are dependent on magnetic field strength, polymer coating of nanoparticles, viscosity of ferrofluid, and dipolar interactions. It is concluded that either by changing the magnitude of magnetic field or the concentrations of nanoparticles, we are able to convert the dominating relaxation process of magnetic nanoparticles from Néel to Brownian, and vice versa. Polymer coatings on nanoparticles and viscosity of ferrofluids are demonstrated to have varying degrees of influence on effective relaxation times of nanoparticles with different sizes and under different field strengths. Our theoretical models are used to predict the magnetic response of ferrofluid consisting of 35 nm magnetite nanoparticles under alternating magnetic fields, and it turns out that our theoretical data fits well with the experimental data.
Origin of the magnetic-field dependence of the nuclear spin-lattice relaxation in iron
Seewald, G; Körner, H J; Borgmann, D; Dietrich, M
2008-01-01
The magnetic-field dependence of the nuclear spin-lattice relaxation at Ir impurities in Fe was measured for fields between 0 and 2 T parallel to the [100] direction. The reliability of the applied technique of nuclear magnetic resonance on oriented nuclei was demonstrated by measurements at different radio-frequency (rf) field strengths. The interpretation of the relaxation curves, which used transition rates to describe the excitation of the nuclear spins by a frequency-modulated rf field, was confirmed by model calculations. The magnetic-field dependence of the so-called enhancement factor for rf fields, which is closely related to the magnetic-field dependence of the spin-lattice relaxation, was also measured. For several magnetic-field-dependent relaxation mechanisms, the form and the magnitude of the field dependence were derived. Only the relaxation via eddy-current damping and Gilbert damping could explain the observed field dependence. Using reasonable values of the damping parameters, the field depe...
Brinzanik, R.; Jensen, P. J.; Bennemann, K. H.
2003-11-01
For growing inhomogeneous thin films with an island nanostructure similar to that observed in experiment we determine the nonequilibrium and the equilibrium remanent magnetization. The single-island magnetic anisotropy, the dipole coupling, and the exchange interaction between magnetic islands are taken into account within a micromagnetic model. A cluster Monte Carlo method is developed which includes coherent magnetization changes of connected islands. This causes a fast relaxation towards equilibrium for irregularly connected systems. We analyze the transition from dipole coupled islands at low coverages to a strongly connected ferromagnetic film at high coverages during film growth. For coverages below the percolation threshold the dipole interaction induces a collective magnetic order with ordering temperatures of 1 10 K for the assumed model parameters. Anisotropy causes blocking temperatures of 10 100 K and thus pronounced nonequilibrium effects. The dipole coupling leads to a somewhat slower magnetic relaxation.
Dobák, Samuel; Füzer, Ján; Kollár, Peter; Fáberová, Mária; Bureš, Radovan
2017-03-01
This study sheds light on the dynamic magnetization process in iron/resin soft magnetic composites from the viewpoint of quantitative decomposition of their complex permeability spectra into the viscous domain wall motion and magnetization rotation. We present a comprehensive view on this phenomenon over the broad family of samples with different average particles dimension and dielectric matrix content. The results reveal the pure relaxation nature of magnetization processes without observation of spin resonance. The smaller particles and higher amount of insulating resin result in the prevalence of rotations over domain wall movement. The findings are elucidated in terms of demagnetizing effects rising from the heterogeneity of composite materials.
Dynamic Nuclear Polarization and Relaxation of H and D Atoms in Solid Mixtures of Hydrogen Isotopes
Sheludiakov, S.; Ahokas, J.; Järvinen, J.; Vainio, O.; Lehtonen, L.; Vasiliev, S.; Lee, D. M.; Khmelenko, V. V.
2016-12-01
We report on a study of dynamic nuclear polarization and electron and nuclear spin relaxation of atomic hydrogen and deuterium in solid molecular matrices of H2, D2 , and HD mixtures. The electron and nuclear spin relaxation times (T_{1e} and T_{1N} ) were measured within the temperature range 0.15-2.5 K in a magnetic field of 4.6 T, conditions which ensure a high polarization of electron spins. We found that T_{1e} is nearly temperature independent in this temperature range, while T_{1N} decreased by two orders of magnitude upon raising temperature. Such strong temperature dependence is typical for the nuclear Orbach mechanism of relaxation via the electron spins. We found that the nuclear spins of H atoms in solid D2 and D2{:}HD can be efficiently polarized by the Overhauser effect. Pumping the forbidden transitions of H atoms also leads to DNP, with the efficiency strongly dependent on the concentration of D atoms. This behavior indicates the cross effect mechanism of the DNP and nuclear relaxation, which turns out to be well resolved in the conditions of our experiments. Efficient DNP of H atoms was also observed when pumping the middle D line located in the center of the ESR spectrum. This phenomenon can be explained in terms of clusters or pairs of H atoms with a strong exchange interaction. These clusters have partially allowed transitions in the center of the ESR spectrum, and DNP may be created via the resolved cross effect.
Nuclear magnetic relaxation by the dipolar EMOR mechanism: Multi-spin systems
Chang, Zhiwei; Halle, Bertil
2017-08-01
In aqueous systems with immobilized macromolecules, including biological tissues, the longitudinal spin relaxation of water protons is primarily induced by exchange-mediated orientational randomization (EMOR) of intra- and intermolecular magnetic dipole-dipole couplings. Starting from the stochastic Liouville equation, we have previously developed a rigorous EMOR relaxation theory for dipole-coupled two-spin and three-spin systems. Here, we extend the stochastic Liouville theory to four-spin systems and use these exact results as a guide for constructing an approximate multi-spin theory, valid for spin systems of arbitrary size. This so-called generalized stochastic Redfield equation (GSRE) theory includes the effects of longitudinal-transverse cross-mode relaxation, which gives rise to an inverted step in the relaxation dispersion profile, and coherent spin mode transfer among solid-like spins, which may be regarded as generalized spin diffusion. The GSRE theory is compared to an existing theory, based on the extended Solomon equations, which does not incorporate these phenomena. Relaxation dispersion profiles are computed from the GSRE theory for systems of up to 16 protons, taken from protein crystal structures. These profiles span the range from the motional narrowing limit, where the coherent mode transfer plays a major role, to the ultra-slow motion limit, where the zero-field rate is closely related to the strong-collision limit of the dipolar relaxation rate. Although a quantitative analysis of experimental data is beyond the scope of this work, it is clear from the magnitude of the predicted relaxation rate and the shape of the relaxation dispersion profile that the dipolar EMOR mechanism is the principal cause of water-1H low-field longitudinal relaxation in aqueous systems of immobilized macromolecules, including soft biological tissues. The relaxation theory developed here therefore provides a basis for molecular-level interpretation of endogenous soft
Dynamic isotope effects on relaxation of quadrupolar nuclei in 12 simple organic molecules
毛希安; andM.Holz
1995-01-01
Dynamic isotope effects on relaxation rate of quadrupolar nuclei are preliminarily reported. The relaxation rates of 17O and 14N in 12 simple organic molecules and their 18 corresponding deuterated species have been systematically measured. The principal components of the molecular inertia tensors have been calculated. The results show that there is an intrinsic correlation between the dynamic isotope effects of the relaxation rate and the static isotope effects of the molecular inertia. The concepts of molecular collision frequency and translation-rotation coupling have been introduced into the NMR relaxation theory. Therefore, a reasonable explanation of the experimental results has been given.
Zhang, Yue; Lynn, Alan; Gilmore, Mark; Hsu, Scott
2012-10-01
A compact coaxial plasma gun is employed for experimental studies of plasma relaxation process being conducted in the HELCAT device at UNM. These studies will advance the knowledge of basic plasma physics in the areas of magnetic relaxation and space and astrophysical plasmas, including the evolution of active galactic jets/radio lobes. The gun is powered by a 120pF ignitron-switched capacitor bank which is operated in a range of 5 - 10kV. Multiple diagnostics are employed to investigate plasma relaxation process. Magnetized Argon plasma bubbles with velocities 1.2Cs and densities 10e20 m-3 have been achieved. Different distinct regimes of operation with qualitatively different dynamics are identified by fast CCD camera images, with the parameter lambda determining the operation regime. Additionally, a B-dot probe array is employed to measure the spatial toroidal and poloidal magnetic flux evolution to identify detached plasma bubble configurations. Experimental data and analysis will be presented.
Sappey, R; Ocio, M; Hammann, J
2000-01-01
We discuss here the nature of the low-temperature magnetic relaxation in samples of magnetic nanoparticles. In addition to usual magnetic viscosity measurement, we have used the residual memory ratio (RMR) method. This procedure enables us to overcome the uncertainties usually associated with the energy barrier distribution, thus giving a more detailed insight on the nature of the observed dynamics. A custom-made apparatus coupling dilution refrigeration and SQUID magnetometry allowed measurements of very diluted samples at temperatures ranging between 60 mK and 7 K. Two types of particles have been studied: gamma-Fe sub 2 O sub 3 of moderate anisotropy, and CoFe sub 2 O sub 4 of higher anisotropy where quantum effects are more likely to occur. In both cases, the data cannot simply be interpreted in terms of mere thermally activated dynamics of independent particles. The deviation from thermal activation seems to go opposite of what is expected from the possible effect of particle interactions. We therefore b...
Liu, Qing; Shi, Chaowei [Hefei National Laboratory for Physical Sciences at The Microscale and School of Life Sciences, University of Science and Technology of China, Hefei, Anhui, 230026 (China); Yu, Lu [Hefei National Laboratory for Physical Sciences at The Microscale and School of Life Sciences, University of Science and Technology of China, Hefei, Anhui, 230026 (China); High Magnetic Field Laboratory, Chinese Academy of Science, Hefei, Anhui, 230031 (China); Zhang, Longhua [Hefei National Laboratory for Physical Sciences at The Microscale and School of Life Sciences, University of Science and Technology of China, Hefei, Anhui, 230026 (China); Xiong, Ying, E-mail: yxiong73@ustc.edu.cn [Hefei National Laboratory for Physical Sciences at The Microscale and School of Life Sciences, University of Science and Technology of China, Hefei, Anhui, 230026 (China); Tian, Changlin, E-mail: cltian@ustc.edu.cn [Hefei National Laboratory for Physical Sciences at The Microscale and School of Life Sciences, University of Science and Technology of China, Hefei, Anhui, 230026 (China); High Magnetic Field Laboratory, Chinese Academy of Science, Hefei, Anhui, 230031 (China)
2015-02-13
Internal backbone dynamic motions are essential for different protein functions and occur on a wide range of time scales, from femtoseconds to seconds. Molecular dynamic (MD) simulations and nuclear magnetic resonance (NMR) spin relaxation measurements are valuable tools to gain access to fast (nanosecond) internal motions. However, there exist few reports on correlation analysis between MD and NMR relaxation data. Here, backbone relaxation measurements of {sup 15}N-labeled SH3 (Src homology 3) domain proteins in aqueous buffer were used to generate general order parameters (S{sup 2}) using a model-free approach. Simultaneously, 80 ns MD simulations of SH3 domain proteins in a defined hydrated box at neutral pH were conducted and the general order parameters (S{sup 2}) were derived from the MD trajectory. Correlation analysis using the Gromos force field indicated that S{sup 2} values from NMR relaxation measurements and MD simulations were significantly different. MD simulations were performed on models with different charge states for three histidine residues, and with different water models, which were SPC (simple point charge) water model and SPC/E (extended simple point charge) water model. S{sup 2} parameters from MD simulations with charges for all three histidines and with the SPC/E water model correlated well with S{sup 2} calculated from the experimental NMR relaxation measurements, in a site-specific manner. - Highlights: • Correlation analysis between NMR relaxation measurements and MD simulations. • General order parameter (S{sup 2}) as common reference between the two methods. • Different protein dynamics with different Histidine charge states in neutral pH. • Different protein dynamics with different water models.
Stretched exponential relaxation of viscous remanence and magnetic dating of erratic boulders
Sato, T.; Nakamura, N.; Nagahama, H.; Minoura, K.
2016-11-01
Viscous remanence continuously increases with the duration of reorientation of rocks, and the remanence gets partially overprinted in rocks parallel to the Earth's magnetic field. This overprinted viscous remanence is unblocked at a certain temperature that enables the estimation of the time required for the rock to acquire the magnetism, by assuming the exponential law of Néel's single-domain theory. However, previous results of dating the rocks by the exponential law have shown older ages than radiometric or cosmogenic exposure ages. Néel's exponential decay law is applicable to a system whose magnetic grains have an identical relaxation time. However, in real systems, the expected behavior is not usually observed because relaxation times vary for individual grains. Moreover, the variation of viscous remanence with the logarithmic law for a distribution of relaxation times is predicted to be concave downward. Here we found that the stretched exponential law, exp{-(t/τ)1 - n} with 0 ≤ n radiometric age.
Calandrini, V. [Centre de Biophysique Moleculaire, Rue Charles Sadron, 45071 Orleans (France); Synchrotron Soleil, L' Orme de Merisiers, B.P. 48, 91192 Gif-sur-Yvette (France); Hamon, V. [Centre de Biophysique Moleculaire, Rue Charles Sadron, 45071 Orleans (France); Hinsen, K. [Centre de Biophysique Moleculaire, Rue Charles Sadron, 45071 Orleans (France); Synchrotron Soleil, L' Orme de Merisiers, B.P. 48, 91192 Gif-sur-Yvette (France); Calligari, P. [Centre de Biophysique Moleculaire, Rue Charles Sadron, 45071 Orleans (France); Institut Laue-Langevin, 6 Rue Jules Horowitz, B.P. 156, 38042 Grenoble (France); Laboratoire Leon Brillouin, CEA Saclay, 91191 Gif-sur-Yvette (France); Bellissent-Funel, M.-C. [Laboratoire Leon Brillouin, CEA Saclay, 91191 Gif-sur-Yvette (France); Kneller, G.R. [Centre de Biophysique Moleculaire, Rue Charles Sadron, 45071 Orleans (France); Synchrotron Soleil, L' Orme de Merisiers, B.P. 48, 91192 Gif-sur-Yvette (France)], E-mail: kneller@cnrs-orleans.fr
2008-04-18
This paper presents a study of the influence of non-denaturing hydrostatic pressure on the relaxation dynamics of lysozyme in solution, which combines molecular dynamics simulations and quasielastic neutron scattering experiments. We compare results obtained at ambient pressure and at 3 kbar. Experiments have been performed at pD 4.6 and at a protein concentration of 60 mg/ml. For both pressures we checked the monodispersity of the protein solution by small angle neutron scattering. To interpret the simulation results and the experimental data, we adopt the fractional Ornstein-Uhlenbeck process as a model for the internal relaxation dynamics of the protein. On the experimental side, global protein motions are accounted for by the model of free translational diffusion, neglecting the much slower rotational diffusion. We find that the protein dynamics in the observed time window from about 1 to 100 ps is slowed down under pressure, while its fractal characteristics is preserved, and that the amplitudes of the motions are reduced by about 20%. The slowing down of the relaxation is reduced with increasing q-values, where more localized motions are seen.
Iwaoka, Nobuyuki; Hagita, Katsumi; Takano, Hiroshi
2014-03-01
On the basis of relaxation mode analysis (RMA), we present an efficient method to estimate the linear viscoelasticity of polymer melts in a molecular dynamics (MD) simulation. Slow relaxation phenomena appeared in polymer melts cause a problem that a calculation of the stress relaxation function in MD simulations, especially in the terminal time region, requires large computational efforts. Relaxation mode analysis is a method that systematically extracts slow relaxation modes and rates of the polymer chain from the time correlation of its conformations. We show the computational cost may be drastically reduced by combining a direct calculation of the stress relaxation function based on the Green-Kubo formula with the relaxation rates spectra estimated by RMA. N. I. acknowledges the Graduate School Doctoral Student Aid Program from Keio University.
Electronic excited states and relaxation dynamics in polymer heterojunction systems
Ramon, John Glenn Santos
The potential for using conducting polymers as the active material in optoelectronic devices has come to fruition in the past few years. Understanding the fundamental photophysics behind their operations points to the significant role played by the polymer interface in their performance. Current device architectures involve the use of bulk heterojunctions which intimately blend the donor and acceptor polymers to significantly increase not only their interfacial surface area but also the probability of exciton formation within the vicinity of the interface. In this dissertation, we detail the role played by the interface on the behavior and performance of bulk heterojunction systems. First, we explore the relation between the exciton binding energy to the band offset in determining device characteristics. As a general rule, when the exciton binding energy is greater than the band offset, the exciton remains the lowest energy excited state leading to efficient light-emitting properties. On the other hand, if the offset is greater than the binding energy, charge separation becomes favorable leading to better photovoltaic behavior. Here, we use a Wannier function, configuration interaction based approach to examine the essential excited states and predict the vibronic absorption and emission spectra of the PPV/BBL, TFB/F8BT and PFB/F8BT heterojunctions. Our results underscore the role of vibrational relaxation in the formation of charge-transfer states following photoexcitation. In addition, we look at the relaxation dynamics that occur upon photoexcitation. For this, we adopt the Marcus-Hush semiclassical method to account for lattice reorganization in the calculation of the interconversion rates in TFB/F8BT and PFB/F8BT. We find that, while a tightly bound charge-transfer state (exciplex) remains the lowest excited state, a regeneration pathway to the optically active lowest excitonic state in TFB/F8BT is possible via thermal repopulation from the exciplex. Finally
Magnetic Field Effects on Relaxation Parameters of The Hexamethylenetetramine (HMT)
Dogan, Nurcan
2013-03-01
The use of low magnetic field is one of the method for improvement of the signal to noise ratio (SNR) of detection of the chemical compounds by nuclear quadrupole resonance (NQR). We investigated the FID phenomenon of nuclear quadrupole resonance (NQR) from hexamethylenetetramine (HMT), C6H12N4, under magnetic field. The influence of the low magnetic field (up to 30 mT) was investigated for the detection of the pulse NQR signal for HMT We detected the pure NQR FID signal of HMT with a short pulse interval. The intensity of the FID signal changed with applied magnetic field. The application of the low magnetic field produces the splitting and brodening of the NQR line. We observed T1, T2 and T2*. HMT has a long T2*(near 1.5ms). This one represents the suitable sample for investigation of the influence of low magnetic field for NQR detection. The application of the low magnetic field produces the splitting and brodening of the NQR line.
Rangel, David P; Baveye, Philippe C; Robinson, Bruce H
2012-06-07
We simulate spin relaxation processes, which may be measured by either continuous wave or pulsed magnetic resonance techniques, using trajectory-based simulation methodologies. The spin-lattice relaxation rates are extracted numerically from the relaxation simulations. The rates obtained from the numerical fitting of the relaxation curves are compared to those obtained by direct simulation from the relaxation Bloch-Wangsness-Abragam-Redfield theory (BWART). We have restricted our study to anisotropic rigid-body rotational processes, and to the chemical shift anisotropy (CSA) and a single spin-spin dipolar (END) coupling mechanisms. Examples using electron paramagnetic resonance (EPR) nitroxide and nuclear magnetic resonance (NMR) deuterium quadrupolar systems are provided. The objective is to compare those rates obtained by numerical simulations with the rates obtained by BWART. There is excellent agreement between the simulated and BWART rates for a Hamiltonian describing a single spin (an electron) interacting with the bath through the chemical shift anisotropy (CSA) mechanism undergoing anisotropic rotational diffusion. In contrast, when the Hamiltonian contains both the chemical shift anisotropy (CSA) and the spin-spin dipolar (END) mechanisms, the decay rate of a single exponential fit of the simulated spin-lattice relaxation rate is up to a factor of 0.2 smaller than that predicted by BWART. When the relaxation curves are fit to a double exponential, the slow and fast rates extracted from the decay curves bound the BWART prediction. An extended BWART theory, in the literature, includes the need for multiple relaxation rates and indicates that the multiexponential decay is due to the combined effects of direct and cross-relaxation mechanisms.
Relaxation dynamics of amorphous dibucaine using dielectric studies
Sahra, M.; Jumailath, K.; Thayyil, M. Shahin; Capaccioli, S.
2015-06-01
Using broadband dielectric spectroscopy the molecular mobility of dibucaine is investigated in the supercooled liquid and gassy states, over a wide temperature range for some test frequencies. Above the glass transition temperature Tg, the presence of structural α- relaxation peak was observed due to the cooperative motions of the molecule and upon cooling frozen kinetically to form the glass. The secondary relaxation process was perceivable below Tg due to localized motions. The peak loss frequency of α-relaxation process shows non-Arrhenius behavior and obeys Vogel-Fulcher-Tammann equation over the measured temperature range whereas the β- process shows Arrhenius behavior.
Anomalous hyperfine coupling and nuclear magnetic relaxation in Weyl semimetals
Okvátovity, Zoltán; Simon, Ferenc; Dóra, Balázs
2016-12-01
The electron-nuclear hyperfine interaction shows up in a variety of phenomena including, e.g., NMR studies of correlated states and spin decoherence effects in quantum dots. Here we focus on the hyperfine coupling and the NMR spin relaxation time T1 in Weyl semimetals. Since the density of states in Weyl semimetals varies with the square of the energy around the Weyl point, a naive power counting predicts a 1 /T1T ˜E4 scaling, with E the maximum of temperature (T ) and chemical potential. By carefully investigating the hyperfine interaction between nuclear spins and Weyl fermions, we find that while its spin part behaves conventionally, its orbital part diverges unusually, with the inverse of the energy around the Weyl point. Consequently, the nuclear spin relaxation rate scales in a graphenelike manner as 1 /T1T ˜E2ln(E /ω0) , with ω0 the nuclear Larmor frequency. This allows us to identify an effective hyperfine coupling constant, which is tunable by gating or doping. This is relevant for the decoherence effect in spintronics devices and double quantum dots, where hyperfine coupling is the dominant source of spin-blockade lifting.
Dias, F. T.; Vieira, V. N.; Garcia, E. L.; Wolff-Fabris, F.; Kampert, E.; Gouvêa, C. P.; Schaf, J.; Obradors, X.; Puig, T.; Roa, J. J.
2016-10-01
We have studied the functional behavior of the field-cooled (FC) magnetic relaxation observed in melt-textured YBa2Cu3O7-δ (Y123) samples with 30 wt% of Y2Ba1Cu1O5 (Y211) phase, in order to investigate anomalous paramagnetic moments observed during the experiments. FC magnetic relaxation experiments were performed under controlled conditions, such as cooling rate and temperature. Magnetic fields up to 5T were applied parallel to the ab plane and along the c-axis. Our results are associated with the paramagnetic Meissner effect (PME), characterized by positive moments during FC experiments, and related to the magnetic flux compression into the samples. After different attempts our experimental data could be adequately fitted by an exponential decay function with different relaxation times. We discuss our results suggesting the existence of different and preferential flux dynamics governing the anomalous FC paramagnetic relaxation in different time intervals. This work is one of the first attempts to interpret this controversial effect in a simple analysis of the pinning mechanisms and flux dynamics acting during the time evolution of the magnetic moment. However, the results may be useful to develop models to explain this interesting and still misunderstood feature of the paramagnetic Meissner effect.
Robust determination of surface relaxivity from nuclear magnetic resonance DT2 measurements
Luo, Zhi-Xiang; Paulsen, Jeffrey; Song, Yi-Qiao
2015-10-01
Nuclear magnetic resonance (NMR) is a powerful tool to probe into geological materials such as hydrocarbon reservoir rocks and groundwater aquifers. It is unique in its ability to obtain in situ the fluid type and the pore size distributions (PSD). The T1 and T2 relaxation times are closely related to the pore geometry through the parameter called surface relaxivity. This parameter is critical for converting the relaxation time distribution into the PSD and so is key to accurately predicting permeability. The conventional way to determine the surface relaxivity ρ2 had required independent laboratory measurements of the pore size. Recently Zielinski et al. proposed a restricted diffusion model to extract the surface relaxivity from the NMR diffusion-T2 relaxation (DT2) measurement. Although this method significantly improved the ability to directly extract surface relaxivity from a pure NMR measurement, there are inconsistencies with their model and it relies on a number of preset parameters. Here we propose an improved signal model to incorporate a scalable LT and extend their method to extract the surface relaxivity based on analyzing multiple DT2 maps with varied diffusion observation time. With multiple diffusion observation times, the apparent diffusion coefficient correctly describes the restricted diffusion behavior in samples with wide PSDs, and the new method does not require predetermined parameters, such as the bulk diffusion coefficient and tortuosity. Laboratory experiments on glass beads packs with the beads diameter ranging from 50 μm to 500 μm are used to validate the new method. The extracted diffusion parameters are consistent with their known values and the determined surface relaxivity ρ2 agrees with the expected value within ±7%. This method is further successfully applied on a Berea sandstone core and yields surface relaxivity ρ2 consistent with the literature.
Robust determination of surface relaxivity from nuclear magnetic resonance DT(2) measurements.
Luo, Zhi-Xiang; Paulsen, Jeffrey; Song, Yi-Qiao
2015-10-01
Nuclear magnetic resonance (NMR) is a powerful tool to probe into geological materials such as hydrocarbon reservoir rocks and groundwater aquifers. It is unique in its ability to obtain in situ the fluid type and the pore size distributions (PSD). The T1 and T2 relaxation times are closely related to the pore geometry through the parameter called surface relaxivity. This parameter is critical for converting the relaxation time distribution into the PSD and so is key to accurately predicting permeability. The conventional way to determine the surface relaxivity ρ2 had required independent laboratory measurements of the pore size. Recently Zielinski et al. proposed a restricted diffusion model to extract the surface relaxivity from the NMR diffusion-T2 relaxation (DT2) measurement. Although this method significantly improved the ability to directly extract surface relaxivity from a pure NMR measurement, there are inconsistencies with their model and it relies on a number of preset parameters. Here we propose an improved signal model to incorporate a scalable LT and extend their method to extract the surface relaxivity based on analyzing multiple DT2 maps with varied diffusion observation time. With multiple diffusion observation times, the apparent diffusion coefficient correctly describes the restricted diffusion behavior in samples with wide PSDs, and the new method does not require predetermined parameters, such as the bulk diffusion coefficient and tortuosity. Laboratory experiments on glass beads packs with the beads diameter ranging from 50 μm to 500 μm are used to validate the new method. The extracted diffusion parameters are consistent with their known values and the determined surface relaxivity ρ2 agrees with the expected value within ±7%. This method is further successfully applied on a Berea sandstone core and yields surface relaxivity ρ2 consistent with the literature.
Du, Jianqing; Zheng, Bo; Wang, Jian-Sheng
2006-05-01
Using a nonequilibrium relaxation method, we calculate the dynamic critical exponent z of the two-dimensional Ising model for the Swendsen-Wang and Wolff algorithms. We examine dynamic relaxation processes following a quench from a disordered or an ordered initial state to the critical temperature Tc, and measure the exponential relaxation time of the system energy. For the Swendsen-Wang algorithm with an ordered or a disordered initial state, and for the Wolff algorithm with an ordered initial state, the exponential relaxation time fits well to a logarithmic size dependence up to a lattice size L = 8192. For the Wolff algorithm with a disordered initial state, we obtain an effective dynamic exponent zexp = 1.19(2) up to L = 2048. For comparison, we also compute the effective dynamic exponents through the integrated correlation times. In addition, an exact result of the Swendsen-Wang dynamic spectrum of a one-dimensional Ising chain is derived.
Chua, Y. Z.; Young-Gonzales, A. R.; Richert, R.; Ediger, M. D.; Schick, C.
2017-07-01
Physical vapor deposition has been used to prepare glasses of ethanol. Upon heating, the glasses transformed into the supercooled liquid phase and then crystallized into the plastic crystal phase. The dynamic glass transition of the supercooled liquid is successfully measured by AC nanocalorimetry, and preliminary results for the plastic crystal are obtained. The frequency dependences of these dynamic glass transitions observed by AC nanocalorimetry are in disagreement with conclusions from previously published dielectric spectra of ethanol. Existing dielectric loss spectra have been carefully re-evaluated considering a Debye peak, which is a typical feature in the dielectric loss spectra of monohydroxy alcohols. The re-evaluated dielectric fits reveal a prominent dielectric Debye peak, a smaller and asymmetrically broadened peak, which is identified as the signature of the structural α-relaxation and a Johari-Goldstein secondary relaxation process. This new assignment of the dielectric processes is supported by the observation that the AC nanocalorimetry dynamic glass transition temperature, Tα, coincides with the dielectric structural α-relaxation process rather than the Debye process. The combined results from dielectric spectroscopy and AC nanocalorimetry on the plastic crystal of ethanol suggest the occurrence of a Debye process also in the plastic crystal phase.
Conformation and intramolecular relaxation dynamics of semiflexible randomly hyperbranched polymers
Kumar, Amit; Rai, Gobind Ji; Biswas, Parbati
2013-03-01
The conformational and dynamic properties of semiflexible randomly hyperbranched polymers are investigated in dilute solutions within the framework of optimized Rouse-Zimm formalism. Semiflexibility is incorporated by restricting the directions and orientations of the respective bond vectors, while hydrodynamic interactions are modeled through the preaveraged Oseen tensor. The effect of semiflexibility is typically reflected in the intermediate frequency regime of the viscoelastic relaxation moduli where the bond orientation angle restores the characteristic power-law scaling in fractal structures, as in randomly hyperbranched polymers. Despite the absence of this power-law scaling regime in flexible randomly hyperbranched polymers and in earlier models of semiflexible randomly branched polymers due to weak disorder [C. von Ferber and A. Blumen, J. Chem. Phys. 116, 8616 (2002)], 10.1063/1.1470198, this power-law behavior may be reinstated by explicitly modeling hyperbranched polymers as a Vicsek fractals. The length of this power-law zone in the intermediate frequency region is a combined function of the number of monomers and the degree of semiflexibility. A clear conformational transition from compact to open structures is facilitated by changing the bond orientation angle, where the compressed conformations are compact, while the expanded ones are relatively non-compact. The extent of compactness in the compressed conformations are much less compared to the semiflexible dendrimers, which resemble hard spheres. The fractal dimensions of the compressed and expanded conformations calculated from the Porod's scaling law vary as a function of the bond orientation angle, spanning the entire range of three distinct scaling regimes of linear polymers in three-dimensions. The results confirm that semiflexibility exactly accounts for the excluded volume interactions which are expected to be significant for such polymers with complex topologies.
Improved magnetization alignment schemes for spin-lock relaxation experiments
Hansen, D. Flemming; Kay, Lewis E. [University of Toronto, Departments of Medical Genetics, Biochemistry and Chemistry (Canada)], E-mail: kay@pound.med.utoronto.ca
2007-04-15
A pair of pulse schemes that spin-lock magnetization efficiently are presented. The design of the sequences benefited from a particularly simple relation that is derived describing to first order the evolution of any magnetization component due to the application of an off-resonance 90{sup o} pulse. The sequences are shown theoretically and experimentally to significantly outperform the 90{sup o}-delay-90{sup o} element that is often used in current applications. It is shown that alignment of magnetization to within 1{sup o} of the effective field can be obtained over a bandwidth extending between [-{omega}{sub SL}, {omega}{sub SL}], where {omega}{sub SL} is the strength of the spin-lock field using a simple scheme that is an order of magnitude shorter than an adiabatic pulse that might also be used for a similar purpose.
Magnetic relaxation induced by transverse flux shaking in MgB2 superconductors
Luzuriaga, J.; Badía-Majós, A.; Nieva, G.; Giordano, J. L.; López, C.; Serquis, A.; Serrano, G.
2009-01-01
We report on measurements and numerical simulations of the behavior of MgB2 superconductors when magnetic field components are applied along mutually perpendicular directions. By closely matching the geometry in simulations and measurements, full quantitative agreement is found. The critical state theory and a single phenomenological law, i.e. the field dependence of the critical current density Jc(B), are sufficient for a full quantitative description of the measurements. These were performed in thick strips of carbon nanotube doped MgB2 samples. Magnetization was measured in two orthogonal directions using a SQUID magnetometer. Magnetic relaxation effects induced by the application of an oscillatory perpendicular field were observed and simulated numerically. The measurements confirm the numerical predictions, that two relaxation regimes appear, depending on the amplitude of the applied magnetic field. The overall agreement constitutes a convincing validation of the critical state model and the numerical procedures used.
Liu, Cai-Ming; Zhang, De-Qing; Zhu, Dao-Ben
2013-10-01
An alkoxido-bridged tetranuclear Dy(iii) complex, [Dy4(H3L)2(OAc)6]·2EtOH {, H6L = 1,3-bis[tris(hydroxymethyl)methylamino]propane}, has been solvothermally synthesized and characterized. An X-ray crystallographic study revealed that complex possesses a novel "parallelogram" [Dy4(OCH2-)4] core, and a new binding mode η(3):η(3):η(1):η(1):η(1):η(2):μ(4) of the Bis-tris propane ligand was observed. Magnetic investigations indicated that it is a single-molecule magnet (SMM), showing two distinct magnetic relaxation processes with the energy barriers of 44 K and 107 K, respectively. Such a two-step magnetic relaxation process could be well described by the sum of two modified Debye functions.
A proton NMR relaxation study of water dynamics in bovine serum albumin nanoparticles.
Belotti, Monica; Martinelli, Andrea; Gianferri, Raffaella; Brosio, Elvino
2010-01-14
Water dynamics and compartmentation in glutaraldehyde cross-linked bovine serum albumin nanoparticles have been investigated by an integrated nuclear magnetic resonance (NMR) protocol based on water relaxation times and self-diffusion coefficients measurements. Multi-exponentially of water relaxation curves has been accounted for according to a diffusive and chemical exchange model (see B. P. Hills, S. F. Takacs and P. S. Belton, Mol. Phys., 1989, 67(4), 903, and Mol. Phys., 1989, 67(4), 913; E. Brosio, M. Belotti and R. Gianferri, in Food Science and Technology: New Research, ed. L. V. Greco and M. N. Bruno, Nova Science Publishers, Hauppauge (NY), 2008) that made it possible to single out water molecules in the molecular spaces in the interior of albumin nanoparticles, in the meso-cavities formed by packed nanoparticles and in the meniscus on top of the nanoparticles suspension. A quantitative rationalization of T(2) values of water different components allowed morphological information to be acquired as for the size of water filled compartments, while self-diffusion coefficient measurements of water excess or fluxed packed nanoparticles suspensions are describers of transport properties of soft biomaterials. The paper reports an NMR approach that can be seen as a general and relevant method to characterize excess-water-swollen soft biomaterials.
Jing Ju Lu; Hong Yuan Deng; Huei Li Huang E-mail: hlhuang@phys.ntu.edu.tw
2000-02-01
Dipole interaction makes average energy barrier of magnetic fine particles for thermal relaxation reduced while the corresponding blocking temperature distribution is a function of both dipolar interaction strength and particle size distribution of the system. Flatness and fast drop-off of the {lambda}-shape behavior of the field-cooled and zero-field-cooled magnetization varies with both dipolar intereaction strength and field level applied.
Park, Kyoungchul; Sonkusale, Sameer [Department of Electrical and Computer Engineering, Tufts University, Medford, MA 02155 (United States); Harrah, Tim; Goldberg, Edward B [Department of Molecular Biology and Microbiology, Tufts University, Boston, MA 02111 (United States); Guertin, Robert P, E-mail: sameer@ece.tufts.edu [Department of Physics and Astronomy, Tufts University, Medford, MA 02155 (United States)
2011-02-25
A novel multiplexed sensing scheme based on the measurement of the magnetic susceptibility of the affinity captured target molecules on magnetic nanoparticles in liquid suspension is proposed. The AC magnetic susceptibility provides a measurement of Brownian relaxation behavior of biomolecules bound to magnetic nanoparticles (MNPs) that is related to its hydrodynamic size. A room temperature, compact AC susceptometer is designed and developed to measure complex AC magnetic susceptibility of such magnetic nanoparticles. The AC susceptometer exhibits high sensitivity in magnetic fields as low as 10 {mu}T for 1 mg ml{sup -1} concentration and 5 {mu}l volume, and is fully software programmable. The capability of biological sensing using the proposed scheme has been demonstrated in proof of principle using the binding of biotinylated horseradish peroxidase (HRP) to streptavidin-coated MNPs. The proposed technique and instrument are readily compatible with lab-on-chip applications for point-of-care medical applications.
Mercury's Dynamic Magnetic Tail
Slavin, James A.
2010-01-01
The Mariner 10 and MESSENGER flybys of Mercury have revealed a magnetosphere that is likely the most responsive to upstream interplanetary conditions of any in the solar system. The source of the great dynamic variability observed during these brief passages is due to Mercury's proximity to the Sun and the inverse proportionality between reconnection rate and solar wind Alfven Mach number. However, this planet's lack of an ionosphere and its small physical dimensions also contribute to Mercury's very brief Dungey cycle, approx. 2 min, which governs the time scale for internal plasma circulation. Current observations and understanding of the structure and dynamics of Mercury's magnetotail are summarized and discussed. Special emphasis will be placed upon such questions as: 1) How much access does the solar wind have to this small magnetosphere as a function of upstream conditions? 2) What roles do heavy planetary ions play? 3) Do Earth-like substorms take place at Mercury? 4) How does Mercury's tail respond to extreme solar wind events such coronal mass ejections? Prospects for progress due to advances in the global magnetohydrodynamic and hybrid simulation modeling and the measurements to be taken by MESSENGER after it enters Mercury orbit on March 18, 2011 will be discussed.
Mitchell, J; Chandrasekera, T C; Johns, M L; Gladden, L F; Fordham, E J
2010-02-01
It is known that internal magnetic field gradients in porous materials, caused by susceptibility differences at the solid-fluid interfaces, alter the observed effective Nuclear Magnetic Resonance transverse relaxation times T2,eff. The internal gradients scale with the strength of the static background magnetic field B0. Here, we acquire data at various magnitudes of B0 to observe the influence of internal gradients on T2-T2 exchange measurements; the theory discussed and observations made are applicable to any T2-T2 analysis of heterogeneous materials. At high magnetic field strengths, it is possible to observe diffusive exchange between regions of local internal gradient extrema within individual pores. Therefore, the observed exchange pathways are not associated with pore-to-pore exchange. Understanding the significance of internal gradients in transverse relaxation measurements is critical to interpreting these results. We present the example of water in porous sandstone rock and offer a guideline to determine whether an observed T2,eff relaxation time distribution reflects the pore size distribution for a given susceptibility contrast (magnetic field strength) and spin echo separation. More generally, we confirm that for porous materials T1 provides a better indication of the pore size distribution than T2,eff at high magnetic field strengths (B0>1 T), and demonstrate the data analysis necessary to validate pore size interpretations of T2,eff measurements.
Space and time dynamical heterogeneity in glassy relaxation. The role of democratic clusters
Appignanesi, G A; Rodriguez Fris, J A [Fisicoquimica, Departamento de Quimica, Universidad Nacional del Sur, Avenida Alem 1253, 8000 BahIa Blanca (Argentina); Seccion de Fisicoquimica, Instituto de Quimica de la Universidad Nacional del Sur, INQUISUR-UNS-CONICET, Universidad Nacional del Sur, Avenida Alem 1253, 8000 BahIa Blanca (Argentina)], E-mail: appignan@criba.edu.ar
2009-05-20
In this work we review recent computational advances in the understanding of the relaxation dynamics of supercooled glass-forming liquids. In such a supercooled regime these systems experience a striking dynamical slowing down which can be rationalized in terms of the picture of dynamical heterogeneities, wherein the dynamics can vary by orders of magnitude from one region of the sample to another and where the sizes and timescales of such slowly relaxing regions are expected to increase considerably as the temperature is decreased. We shall focus on the relaxation events at a microscopic level and describe the finding of the collective motions of particles responsible for the dynamical heterogeneities. In so doing, we shall demonstrate that the dynamics in different regions of the system is not only heterogeneous in space but also in time. In particular, we shall be interested in the events relevant to the long-time structural relaxation or {alpha} relaxation. In this regard, we shall focus on the discovery of cooperatively relaxing units involving the collective motion of relatively compact clusters of particles, called 'democratic clusters' or d-clusters. These events have been shown to trigger transitions between metabasins of the potential energy landscape (collections of similar configurations or structures) and to consist of the main steps in the {alpha} relaxation. Such events emerge in systems quite different in nature such as simple model glass formers and supercooled amorphous water. Additionally, another relevant issue in this context consists in the determination of a link between structure and dynamics. In this context, we describe the relationship between the d-cluster events and the constraints that the local structure poses on the relaxation dynamics, thus revealing their role in reformulating structural constraints. (topical review)
Magnetic relaxation in chain-of-spheres ferromagnetic particles
Yang, J S
2002-01-01
The thermal activation of elongated ferromagnetic particles is analyzed using a chain-of-spheres model. The spheres within the chain are assumed to be coupled magnetically with dipolar interaction. The effect of uniaxial magnetocrystalline anisotropy along the chain is also taken into account. It was shown that the behavior of thermal switching critically depends on the relative strength of shape anisotropy and magnetocrystalline anisotropy, field orientation, sweep field rate and temperature.
Collisional relaxation of a strongly magnetized two-species pure ion plasma
Chim, Chi Yung; O’Neil, Thomas M.; Dubin, Daniel H. [Department of Physics, University of California at San Diego, La Jolla, California 92093 (United States)
2014-04-15
The collisional relaxation of a strongly magnetized pure ion plasma that is composed of two species with slightly different masses is discussed. We have in mind two isotopes of the same singly ionized atom. Parameters are assumed to be ordered as Ω{sub 1},Ω{sub 2}≫|Ω{sub 1}−Ω{sub 2}|≫v{sup ¯}{sub ij}/b{sup ¯} and v{sup ¯}{sub ⊥j}/Ω{sub j}≪b{sup ¯}, where Ω{sub 1} and Ω{sub 2} are two cyclotron frequencies, v{sup ¯}{sub ij}=√(T{sub ∥}/μ{sub ij}) is the relative parallel thermal velocity characterizing collisions between particles of species i and j, and b{sup ¯}=2e{sup 2}/T{sub ∥} is the classical distance of closest approach for such collisions, and v{sup ¯}{sub ⊥j}/Ω{sub j}=√(2T{sub ⊥j}/m{sub j})/Ω{sub j} is the characteristic cyclotron radius for particles of species j. Here, μ{sub ij} is the reduced mass for the two particles, and T{sub ∥} and T{sub ⊥j} are temperatures that characterize velocity components parallel and perpendicular to the magnetic field. For this ordering, the total cyclotron action for the two species, I{sub 1}=∑{sub i∈1}m{sub 1}v{sub ⊥i}{sup 2}/(2Ω{sub 1}) and I{sub 2}=∑{sub i∈2}m{sub 2}v{sub ⊥i}{sup 2}/(2Ω{sub 2}) are adiabatic invariants that constrain the collisional dynamics. On the timescale of a few collisions, entropy is maximized subject to the constancy of the total Hamiltonian H and the two actions I{sub 1} and I{sub 2}, yielding a modified Gibbs distribution of the form exp[−H/T{sub ∥}−α{sub 1}I{sub 1}−α{sub 2}I{sub 2}]. Here, the α{sub j}’s are related to T{sub ∥} and T{sub ⊥j} through T{sub ⊥j}=(1/T{sub ∥}+α{sub j}/Ω{sub j}){sup −1}. Collisional relaxation to the usual Gibbs distribution, exp[−H/T{sub ∥}], takes place on two timescales. On a timescale longer than the collisional timescale by a factor of (b{sup ¯2}Ω{sub 1}{sup 2}/v{sup ¯}{sub 11}{sup 2})exp(5[3π(b{sup ¯}|Ω{sub 1}−Ω{sub 2}|/v{sup ¯}{sub 12})]{sup 2/5}/6), the two
Xiong, Jin; Ding, Hai-Yan; Meng, Yin-Shan; Gao, Chen; Zhang, Xue-Jing; Meng, Zhao-Sha; Zhang, Yi-Quan; Shi, Wei; Wang, Bing-Wu; Gao, Song
2017-02-01
A hydroxide-bridged centrosymmetric Dy(III) dimer with each Dy(III) being five-coordinated has been synthesized using bulky hindered phenolate ligands. Magnetic studies revealed that this compound exhibits a slow magnetic relaxation of a single-ion origin together with a step-like magnetic hysteresis of the magnetic coupled cluster. The thermal relaxation barrier of magnetization is 721 K in the absence of a static magnetic field, while the intramolecular magnetic interaction is very large among reported 4f-only dimers. CASSCF calculations with a larger active space were performed to understand the electronic structure of the compound. The thermal relaxation regime and the quantum tunneling regime are well separated, representing a good model to study the relaxation mechanism of SMMs with intramolecular Dy-Dy magnetic interactions.
Nuclear magnetic relaxation by the dipolar EMOR mechanism: Three-spin systems
Chang, Zhiwei; Halle, Bertil
2016-07-01
In aqueous systems with immobilized macromolecules, including biological tissue, the longitudinal spin relaxation of water protons is primarily induced by exchange-mediated orientational randomization (EMOR) of intra- and intermolecular magnetic dipole-dipole couplings. Starting from the stochastic Liouville equation, we have developed a non-perturbative theory that can describe relaxation by the dipolar EMOR mechanism over the full range of exchange rates, dipole couplings, and Larmor frequencies. Here, we implement the general dipolar EMOR theory for a macromolecule-bound three-spin system, where one, two, or all three spins exchange with the bulk solution phase. In contrast to the previously studied two-spin system with a single dipole coupling, there are now three dipole couplings, so relaxation is affected by distinct correlations as well as by self-correlations. Moreover, relaxation can now couple the magnetizations with three-spin modes and, in the presence of a static dipole coupling, with two-spin modes. As a result of this complexity, three secondary dispersion steps with different physical origins can appear in the longitudinal relaxation dispersion profile, in addition to the primary dispersion step at the Larmor frequency matching the exchange rate. Furthermore, and in contrast to the two-spin system, longitudinal relaxation can be significantly affected by chemical shifts and by the odd-valued ("imaginary") part of the spectral density function. We anticipate that the detailed studies of two-spin and three-spin systems that have now been completed will provide the foundation for developing an approximate multi-spin dipolar EMOR theory sufficiently accurate and computationally efficient to allow quantitative molecular-level interpretation of frequency-dependent water-proton longitudinal relaxation data from biophysical model systems and soft biological tissue.
Arosio, Paolo, E-mail: paolo.arosio@guest.unimi.it; Orsini, Francesco [Department of Physics, Università degli Studi di Milano, and INSTM, Milano (Italy); Corti, Maurizio [Department of Physics, Università degli Studi di Pavia and INSTM, Pavia (Italy); Mariani, Manuel [Department of Physics and Astronomy, Università degli Studi di Bologna, Bologna (Italy); Bogani, Lapo [Physikalisches Institut, Universität Stuttgart, Stuttgart (Germany); Caneschi, Andrea [INSTM and Department of Chemistry, University of Florence, Firenze (Italy); Lago, Jorge [Departamento de Quimica Inorganica, Universidad del Pais Vasco, Bilbao (Spain); Lascialfari, Alessandro [Department of Physics, Università degli Studi di Milano, and INSTM, Milano (Italy); Centro S3, Istituto Nanoscienze - CNR, Modena (Italy)
2015-05-07
The spin dynamics of the molecular magnetic chain [Dy(hfac){sub 3}(NIT(C{sub 6}H{sub 4}OPh))] were investigated by means of the Muon Spin Relaxation (μ{sup +}SR) technique. This system consists of a magnetic lattice of alternating Dy(III) ions and radical spins, and exhibits single-chain-magnet behavior. The magnetic properties of [Dy(hfac){sub 3}(NIT(C{sub 6}H{sub 4}OPh))] have been studied by measuring the magnetization vs. temperature at different applied magnetic fields (H = 5, 3500, and 16500 Oe) and by performing μ{sup +}SR experiments vs. temperature in zero field and in a longitudinal applied magnetic field H = 3500 Oe. The muon asymmetry P(t) was fitted by the sum of three components, two stretched-exponential decays with fast and intermediate relaxation times, and a third slow exponential decay. The temperature dependence of the spin dynamics has been determined by analyzing the muon longitudinal relaxation rate λ{sub interm}(T), associated with the intermediate relaxing component. The experimental λ{sub interm}(T) data were fitted with a corrected phenomenological Bloembergen-Purcell-Pound law by using a distribution of thermally activated correlation times, which average to τ = τ{sub 0} exp(Δ/k{sub B}T), corresponding to a distribution of energy barriers Δ. The correlation times can be associated with the spin freezing that occurs when the system condenses in the ground state.
Relaxation in ordered systems of ultrafine magnetic particles: effect of the exchange interaction.
Russ, Stefanie; Bunde, Armin
2011-03-30
We perform Monte Carlo simulations to study the relaxation of single-domain nanoparticles that are located on a simple cubic lattice with anisotropy axes pointing in the z-direction, under the combined influence of anisotropy energy, dipolar interaction and ferromagnetic interaction of strength J. We compare the results of classical Heisenberg systems with three-dimensional magnetic moments [Formula: see text] to those of Ising systems and find that Heisenberg systems show a much richer and more complex dynamical behavior. In contrast to Heisenberg systems, Ising systems need large activation energies to turn a spin and also possess a smaller configuration space for the orientation of the [Formula: see text]. Accordingly, Heisenberg systems possess a whole landscape of different states with very close-lying energies, while Ising systems tend to get frozen in one random state far away from the ground state. For Heisenberg systems, we identify two phase transitions: (i) at intermediate J between domain and layered states and (ii) at larger J between layered and ferromagnetic states. Between these two transitions, the layered states change their appearance and develop a sub-structure, where the orientation of the [Formula: see text] in each layer depends on J, so that for each value of J, a new ground state appears.
Novel collective magnetic relaxation phenomena in manganites: a spin-glass behavior?
Rivas, J. [Departamento de Fisica Aplicada, Universidad de Santiago de Compostela, E-15782-Santiago de Compostela (Spain)]. E-mail: farivas@usc.es; Rivadulla, F. [Departamento de Quimica-Fisica, Universidad de Santiago de Compostela, E-15782-Santiago de Compostela (Spain); Lopez-Quintela, M.A. [Departamento de Quimica-Fisica, Universidad de Santiago de Compostela, E-15782-Santiago de Compostela (Spain)
2004-12-31
Here we address many of the fundamental open questions regarding the glassy behavior of the magnetic/electronic phase segregated state in rare earth perovskites. Magnetic relaxation (AC/DC) support a scenario in which collective effects (memory, ageing, etc.) can be understood as due to intercluster interactions. We propose that the phase segregated state (PSS) constitutes a sort of self-generated assembly of magnetic clusters in which the magnetic interaction introduces collectivity among them. The strength of the interactions can be tuned by composition and/or magnetic field, through the control of the size and concentration of the magnetic clusters. These results are general, applicable to other systems close to a localized to itinerant transition, like cobaltates, cuprates, etc.
Novel collective magnetic relaxation phenomena in manganites: a spin-glass behavior?
Rivas, J.; Rivadulla, F.; López-Quintela, M. A.
2004-12-01
Here we address many of the fundamental open questions regarding the glassy behavior of the magnetic/electronic phase segregated state in rare earth perovskites. Magnetic relaxation (AC/DC) support a scenario in which collective effects (memory, ageing, etc.) can be understood as due to intercluster interactions. We propose that the phase segregated state (PSS) constitutes a sort of self-generated assembly of magnetic clusters in which the magnetic interaction introduces collectivity among them. The strength of the interactions can be tuned by composition and/or magnetic field, through the control of the size and concentration of the magnetic clusters. These results are general, applicable to other systems close to a localized to itinerant transition, like cobaltates, cuprates, etc.
Østerberg, Frederik Westergaard; Dalslet, Bjarke Thomas; Snakenborg, Detlef
2010-01-01
We present a simple 'click-on' fluidic system with integrated electrical contacts, which is suited for electrical measurements on chips in microfluidic systems. We show that microscopic magnetic field sensors based on the planar Hall effect can be used for detecting the complex magnetic response...... with a constant hydrodynamic bead diameter when the temperature dependence of the viscosity of water is taken into account. These measurements demonstrate the feasibility of performing measurements of the Brownian relaxation response in a lab-on-a-chip system and constitute the first step towards an integrated...... using only the self-field arising from the bias current applied to the sensors as excitation field. We present measurements on a suspension of magnetic beads with a nominal diameter of 250 nm vs. temperature and find that the observations are consistent with the Cole-Cole model for Brownian relaxation...
2014-01-01
Disclosed herein is a biosensor for optical detection of Brownian relaxation dynamics of magnetic particles measured by light transmission. The magnetic particles can be functionalized with biological ligands for the detection of target analytes in a sample. The setup may be implemented in a disc...
Nonomura, Yoshihiko
2014-11-01
Nonequilibrium relaxation behaviors in the Ising model on a square lattice based on the Wolff algorithm are totally different from those based on local-update algorithms. In particular, the critical relaxation is described by the stretched-exponential decay. We propose a novel scaling procedure to connect nonequilibrium and equilibrium behaviors continuously, and find that the stretched-exponential scaling region in the Wolff algorithm is as wide as the power-law scaling region in local-update algorithms. We also find that relaxation to the spontaneous magnetization in the ordered phase is characterized by the exponential decay, not the stretched-exponential decay based on local-update algorithms.
Meihaus, Katie R; Rinehart, Jeffrey D; Long, Jeffrey R
2011-09-05
Magnetically dilute samples of complexes Dy(H(2)BPz(Me2)(2))(3) (1) and U(H(2)BPz(2))(3) (3) were prepared through cocrystallization with diamagnetic Y(H(2)BPz(Me2)(2))(3) (2) and Y(H(2)BPz(2))(3). Alternating current (ac) susceptibility measurements performed on these samples reveal magnetic relaxation behavior drastically different from their concentrated counterparts. For concentrated 1, slow magnetic relaxation is not observed under zero or applied dc fields of several hundred Oersteds. However, a 1:65 (Dy:Y) molar dilution results in a nonzero out-of-phase component to the magnetic susceptibility under zero applied dc field, characteristic of a single-molecule magnet. The highest dilution of 3 (1:90, U:Y) yields a relaxation barrier U(eff) = 16 cm(-1), double that of the concentrated sample. These combined results highlight the impact of intermolecular interactions in mononuclear single-molecule magnets possessing a highly anisotropic metal center. Finally, dilution elucidates the previously observed secondary relaxation process for concentrated 3. This process is slowed down drastically upon a 1:1 molar dilution, leading to butterfly magnetic hysteresis at temperatures as high as 3 K. The disappearance of this process for higher dilutions reveals it to be relaxation dictated by short-range intermolecular interactions, and it stands as the first direct example of an intermolecular relaxation process competing with single-molecule-based slow magnetic relaxation.
Pravdivtsev, Andrey N.; Yurkovskaya, Alexandra V.; Ivanov, Konstantin L., E-mail: ivanov@tomo.nsc.ru [International Tomography Center, Institutskaya 3a, Novosibirsk 630090 (Russian Federation); Department of Physics, Novosibirsk State University, Pirogova 2, Novosibirsk 630090 (Russian Federation); Vieth, Hans-Martin [Institut für Experimentalphysik, Freie Universität Berlin Arnimallee 14, 14195 Berlin (Germany)
2014-10-21
Nuclear Magnetic Relaxation Dispersion (NMRD) of protons was studied in the pentapeptide Met-enkephalin and the amino acids, which constitute it. Experiments were run by using high-resolution Nuclear Magnetic Resonance (NMR) in combination with fast field-cycling, thus enabling measuring NMRD curves for all individual protons. As in earlier works, Papers I–III, pronounced effects of intramolecular scalar spin-spin interactions, J-couplings, on spin relaxation were found. Notably, at low fields J-couplings tend to equalize the apparent relaxation rates within networks of coupled protons. In Met-enkephalin, in contrast to the free amino acids, there is a sharp increase in the proton T{sub 1}-relaxation times at high fields due to the changes in the regime of molecular motion. The experimental data are in good agreement with theory. From modelling the relaxation experiments we were able to determine motional correlation times of different residues in Met-enkephalin with atomic resolution. This allows us to draw conclusions about preferential conformation of the pentapeptide in solution, which is also in agreement with data from two-dimensional NMR experiments (rotating frame Overhauser effect spectroscopy). Altogether, our study demonstrates that high-resolution NMR studies of magnetic field-dependent relaxation allow one to probe molecular mobility in biomolecules with atomic resolution.
Kinetic theories for spin models for cooperative relaxation dynamics
Pitts, Steven Jerome
The facilitated kinetic Ising models with asymmetric spin flip constraints introduced by Jackle and co-workers [J. Jackle, S. Eisinger, Z. Phys. B 84, 115 (1991); J. Reiter, F. Mauch, J. Jackle, Physica A 184, 458 (1992)] exhibit complex relaxation behavior in their associated spin density time correlation functions. This includes the growth of relaxation times over many orders of magnitude when the thermodynamic control parameter is varied, and, in some cases, ergodic-nonergodic transitions. Relaxation equations for the time dependence of the spin density autocorrelation function for a set of these models are developed that relate this autocorrelation function to the irreducible memory function of Kawasaki [K. Kawasaki, Physica A 215, 61 (1995)] using a novel diagrammatic series approach. It is shown that the irreducible memory function in a theory of the relaxation of an autocorrelation function in a Markov model with detailed balance plays the same role as the part of the memory function approximated by a polynomial function of the autocorrelation function with positive coefficients in schematic simple mode coupling theories for supercooled liquids [W. Gotze, in Liquids, Freezing and the Glass Transition, D. Levesque, J. P. Hansen, J. Zinn-Justin eds., 287 (North Holland, New York, 1991)]. Sets of diagrams in the series for the irreducible memory function are summed which lead to approximations of this type. The behavior of these approximations is compared with known results from previous analytical calculations and from numerical simulations. For the simplest one dimensional model, relaxation equations that are closely related to schematic extended mode coupling theories [W. Gotze, ibid] are also derived using the diagrammatic series. Comparison of the results of these approximate theories with simulation data shows that these theories improve significantly on the results of the theories of the simple schematic mode coupling theory type. The potential
Pisane, K.L. [Department of Physics & Astronomy, West Virginia University, Morgantown, WV 26506 (United States); Despeaux, E.C. [Department of Pharmaceutical Sciences, West Virginia University, Morgantown, WV 26506 (United States); Seehra, M.S., E-mail: mseehra@wvu.edu [Department of Physics & Astronomy, West Virginia University, Morgantown, WV 26506 (United States)
2015-06-15
The role of particle size distribution inherently present in magnetic nanoparticles (NPs) is examined in considerable detail in relation to the measured magnetic properties of oleic acid-coated maghemite (γ-Fe{sub 2}O{sub 3}) NPs. Transmission electron microscopy (TEM) of the sol–gel synthesized γ-Fe{sub 2}O{sub 3} NPs showed a log-normal distribution of sizes with average diameter 〈D〉=7.04 nm and standard deviation σ=0.78 nm. Magnetization, M, vs. temperature (2–350 K) of the NPs was measured in an applied magnetic field H up to 90 kOe along with the temperature dependence of the ac susceptibilities, χ′ and χ″, at various frequencies, f{sub m}, from 10 Hz to 10 kHz. From the shift of the blocking temperature from T{sub B}=35 K at 10 Hz to T{sub B}=48 K at 10 kHz, the absence of any significant interparticle interaction is inferred and the relaxation frequency f{sub o}=2.6×10{sup 10} Hz and anisotropy constant K{sub a}=5.48×10{sup 5} erg/cm{sup 3} are determined. For T
Distinguishing magnetic vs. quadrupolar relaxation in b-NMR using 8Li and 9Li
Chatzichristos, A.; McFadden, R. M. L.; Karner, V. L.; Cortie, D. L.; Fang, A.; Levy, C. D. P.; Macfarlane, W. A.; Morris, G. D.; Pearson, M. R.; Salman, Z.; Kiefl, R. F.
2016-09-01
Beta-detected NMR is a powerful technique in condensed matter physics. It uses the parity violation of beta decay to detect the NMR signal from a beam of highly polarized radionuclides implanted in a sample material. Spin-lattice relaxation (SLR) is studied by monitoring the rate with which the asymmetry between the beta counts in two opposing detectors is lost. Unlike classical NMR, b-NMR can study thin films and near-surface effects. The most common b-NMR isotope at TRIUMF is 8Li, which has a quadrupole moment, thus it is sensitive to both magnetic fields and electric field gradients. A challenge with 8Li b-NMR is identifying the predominant mechanism of SLR in a given sample. It is possible to distinguish between SLR mechanisms by varying the probe isotope. For two isotopes with different nuclear moments, the ratio of SLR rates should be different in the limits of either pure magnetic or quadrupolar relaxation. This method has been used in classical NMR and we report its first application to b-NMR. We measured the SLR rates for 8Li and 8Li in Pt foil and SrTiO3. Pt is a test case for pure magnetic relaxation. SrTiO3 is a non-magnetic insulator, but the source of its relaxation is not well understood. Here we show that its relaxation is mainly quadrupolar. We thank TRIUMF's CMMS for their technical support. This work was supported by: NSERC Discovery Grants to R.F.K. and W.A.M.; and IsoSiM fellowships to A.C. and R.M.L.M.
Magnetic droplets and dynamical skyrmions
Akerman, Johan
2015-03-01
Nanocontact spin-torque oscillators (NC-STOs) provide an excellent environment for studying nano-magnetic phenomena such as localized and propagating auto-oscillatory spin wave (SW) modes. The recent experimental observation of magnetic droplet solitons in NC-STOs with perpendicular magnetic anisotropy (PMA) free layers, and the numerical and experimental demonstrations of spin transfer torque (STT) nucleated skyrmions in similar magnetic thin films add two interesting and useful nanoscale magnetic objects. Due to the competition between exchange, anisotropy, and, in the case of skyrmions, the Dzyaloshinskii-Moriya interaction (DMI), the droplet and the skyrmion are extremely compact, on the order of 10-100 nm. One of the main differences between a magnetic dissipative droplet soliton and a skyrmion is that the former is a dynamical object with all its spins precessing around an effective field and stabilized by STT, exchange, and PMA, while the latter has static spins and an internal structure stabilized by DMI, exchange, and PMA. The dissipative droplet is furthermore a non-topological soliton, while the skyrmion is topologically protected. In this work I will report on our most recent droplet experiments, including droplet collapse at very high fields, droplets excited in nano-wire based NC-STOs, and studies of the field-current droplet nucleation boundary. I will also demonstrate numerically and analytically that STT driven precession can stabilize so-called dynamical skyrmions even in the absence of DMI, and I will describe their very promising properties in detail. From a more fundamental perspective, precession is hence a third independent possibility to stabilize a skyrmion, without the need for the conventional stabilization from either dipolar energy or DMI.
Lajevardipour, Alireza; Chon, James W. M.; Chattopadhyay, Amitabha; Clayton, Andrew H. A.
2016-11-01
Spectral relaxation from fluorescent probes is a useful technique for determining the dynamics of condensed phases. To this end, we have developed a method based on wide-field spectral fluorescence lifetime imaging microscopy to extract spectral relaxation correlation times of fluorescent probes in living cells. We show that measurement of the phase and modulation of fluorescence from two wavelengths permit the identification and determination of excited state lifetimes and spectral relaxation correlation times at a single modulation frequency. For NBD fluorescence in glycerol/water mixtures, the spectral relaxation correlation time determined by our approach exhibited good agreement with published dielectric relaxation measurements. We applied this method to determine the spectral relaxation dynamics in membranes of living cells. Measurements of the Golgi-specific C6-NBD-ceramide probe in living HeLa cells revealed sub-nanosecond spectral dynamics in the intracellular Golgi membrane and slower nanosecond spectral dynamics in the extracellular plasma membrane. We interpret the distinct spectral dynamics as a result of structural plasticity of the Golgi membrane relative to more rigid plasma membranes. To the best of our knowledge, these results constitute one of the first measurements of Golgi rotational dynamics.
Lajevardipour, Alireza; Chon, James W M; Chattopadhyay, Amitabha; Clayton, Andrew H A
2016-11-22
Spectral relaxation from fluorescent probes is a useful technique for determining the dynamics of condensed phases. To this end, we have developed a method based on wide-field spectral fluorescence lifetime imaging microscopy to extract spectral relaxation correlation times of fluorescent probes in living cells. We show that measurement of the phase and modulation of fluorescence from two wavelengths permit the identification and determination of excited state lifetimes and spectral relaxation correlation times at a single modulation frequency. For NBD fluorescence in glycerol/water mixtures, the spectral relaxation correlation time determined by our approach exhibited good agreement with published dielectric relaxation measurements. We applied this method to determine the spectral relaxation dynamics in membranes of living cells. Measurements of the Golgi-specific C6-NBD-ceramide probe in living HeLa cells revealed sub-nanosecond spectral dynamics in the intracellular Golgi membrane and slower nanosecond spectral dynamics in the extracellular plasma membrane. We interpret the distinct spectral dynamics as a result of structural plasticity of the Golgi membrane relative to more rigid plasma membranes. To the best of our knowledge, these results constitute one of the first measurements of Golgi rotational dynamics.
Glass transition and relaxation dynamics of propylene glycol-water solutions confined in clay
Elamin, Khalid; Björklund, Jimmy; Nyhlén, Fredrik; Yttergren, Madeleine; Mârtensson, Lena; Swenson, Jan
2014-07-01
The molecular dynamics of aqueous solutions of propylene glycol (PG) and propylene glycol methylether (PGME) confined in a two-dimensional layer-structured Na-vermiculite clay has been studied by broadband dielectric spectroscopy and differential scanning calorimetry. As typical for liquids in confined geometries the intensity of the cooperative α-relaxation becomes considerably more suppressed than the more local β-like relaxation processes. In fact, at high water contents the calorimetric glass transition and related structural α-relaxation cannot even be observed, due to the confinement. Thus, the intensity of the viscosity related α-relaxation is dramatically reduced, but its time scale as well as the related glass transition temperature Tg are for both systems only weakly influenced by the confinement. In the case of the PGME-water solutions it is an important finding since in the corresponding bulk system a pronounced non-monotonic concentration dependence of the glass transition related dynamics has been observed due to the growth of hydrogen bonded relaxing entities of water bridging between PGME molecules [J. Sjöström, J. Mattsson, R. Bergman, and J. Swenson, Phys. Chem. B 115, 10013 (2011)]. The present results suggest that the same type of structural entities are formed in the quasi-two-dimensional space between the clay platelets. It is also observed that the main water relaxation cannot be distinguished from the β-relaxation of PG or PGME in the concentration range up to intermediate water contents. This suggests that these two processes are coupled and that the water molecules affect the time scale of the β-relaxation. However, this is most likely true also for the corresponding bulk solutions, which exhibit similar time scales of this combined relaxation process below Tg. Finally, it is found that at higher water contents the water relaxation does not merge with, or follow, the α-relaxation above Tg, but instead crosses the α-relaxation
Ab initio theory for ultrafast magnetization dynamics with a dynamic band structure
Mueller, B. Y.; Haag, M.; Fähnle, M.
2016-09-01
Laser-induced modifications of magnetic materials on very small spatial dimensions and ultrashort timescales are a promising field for novel storage and spintronic devices. Therefore, the contribution of electron-electron spin-flip scattering to the ultrafast demagnetization of ferromagnets after an ultrashort laser excitation is investigated. In this work, the dynamical change of the band structure resulting from the change of the magnetization in time is taken into account on an ab initio level. We find a large influence of the dynamical band structure on the magnetization dynamics and we illustrate the thermalization and relaxation process after laser irradiation. Treating the dynamical band structure yields a demagnetization comparable to the experimental one.
The role of anharmonic phonons in under-barrier spin relaxation of single molecule magnets
Lunghi, Alessandro; Totti, Federico; Sessoli, Roberta; Sanvito, Stefano
2017-01-01
The use of single molecule magnets in mainstream electronics requires their magnetic moment to be stable over long times. One can achieve such a goal by designing compounds with spin-reversal barriers exceeding room temperature, namely with large uniaxial anisotropies. Such strategy, however, has been defeated by several recent experiments demonstrating under-barrier relaxation at high temperature, a behaviour today unexplained. Here we propose spin–phonon coupling to be responsible for such anomaly. With a combination of electronic structure theory and master equations we show that, in the presence of phonon dissipation, the relevant energy scale for the spin relaxation is given by the lower-lying phonon modes interacting with the local spins. These open a channel for spin reversal at energies lower than that set by the magnetic anisotropy, producing fast under-barrier spin relaxation. Our findings rationalize a significant body of experimental work and suggest a possible strategy for engineering room temperature single molecule magnets. PMID:28262663
Quadratic Zeeman effect and spin-lattice relaxation of Tm$^{3+}$:YAG at high magnetic fields
Veissier, Lucile; Lutz, Thomas; Barclay, Paul E; Tittel, Wolfgang; Cone, Rufus L
2016-01-01
Anisotropy of the quadratic Zeeman effect for the $^3{\\rm H}_6 \\rightarrow \\, ^3{\\rm H}_4$ transition at 793 nm wavelength in $^{169}$Tm$^{3+}$-doped Y$_3$Al$_5$O$_{12}$ is studied, revealing shifts ranging from near zero up to + 4.69 GHz/T$^2$ for ions in magnetically inequivalent sites. This large range of shifts is used to spectrally resolve different subsets of ions and study nuclear spin relaxation as a function of temperature, magnetic field strength, and orientation in a site-selective manner. A rapid decrease in spin lifetime is found at large magnetic fields, revealing the weak contribution of direct-phonon absorption and emission to the nuclear spin-lattice relaxation rate. We furthermore confirm theoretical predictions for the phonon coupling strength, finding much smaller values than those estimated in the limited number of past studies of thulium in similar crystals. Finally, we observe a significant -- and unexpected -- magnetic field dependence of the two-phonon Orbach spin relaxation process a...
Chen, Qi; Li, Jian; Meng, Yin-Shan; Sun, Hao-Ling; Zhang, Yi-Quan; Sun, Jun-Liang; Gao, Song
2016-08-15
A novel two-dimensional dysprosium(III) complex, [Dy(L)(CH3COO)]·0.5DMF·H2O·2CH3OH (1), has been successfully synthesized from a new pyridine-N-oxide (PNO)-containing ligand, namely, N'-(2-hydroxy-3-methoxybenzylidene)pyridine-N-oxidecarbohydrazide (H2L). Single-crystal X-ray diffraction studies reveal that complex 1 is composed of a dinuclear dysprosium subunit, which is further extended by the PNO part of the ligand to form a two-dimensional layer. Magnetic studies indicate that complex 1 shows well-defined temperature- and frequency-dependent signals under a zero direct-current (dc) field, typical of slow magnetic relaxation with an effective energy barrier Ueff of 33.6 K under a zero dc field. Interestingly, powder X-ray diffraction and thermogravimetric analysis reveal that compound 1 undergoes a reversible phase transition that is induced by the desorption and absorption of methanol and water molecules. Moreover, the desolvated sample [Dy(L)(CH3COO)]·0.5DMF (1a) also exhibits slow magnetic relaxation but with a higher anisotropic barrier of 42.0 K, indicating the tuning effect of solvent molecules on slow magnetic relaxation.
Dielectric relaxation dynamics of high-temperature piezoelectric polyimide copolymers
Maceiras, A.; Costa, C. M.; Lopes, A. C.; San Sebastián, M.; Laza, J. M.; Vilas, J. L.; Ribelles, J. L. Gómez; Sabater i Serra, R.; Andrio Balado, A.; Lanceros-Méndez, S.; León, L. M.
2015-08-01
Polyimide copolymers have been prepared based on different diamines as comonomers: a diamine without CN groups and a novel synthesized diamine with two CN groups prepared by polycondensation reaction followed by thermal cyclodehydration. Dielectric spectroscopy measurements were performed, and the dielectric complex function, ac conductivity and electric modulus of the copolymers were investigated as a function of CN group content in the frequency range from 0.1 to 107 Hz at temperatures from 25 to 260 °C. For all samples and temperatures above 150 °C, the dielectric constant increases with increasing temperature due to increasing conductivity. The α-relaxation is just detected for the sample without CN groups, being this relaxation overlapped by the electrical conductivity contributions in the remaining samples. For the copolymer samples and the polymer with CN groups, an important Maxwell-Wagner-Sillars contribution is detected. The mechanisms responsible for the dielectric relaxation, conduction process and electric modulus response have been discussed as a function of the CN group content present in the samples.
Metal-Organic Framework of Lanthanoid Dinuclear Clusters Undergoes Slow Magnetic Relaxation
Hikaru Iwami
2017-01-01
Full Text Available Lanthanoid metal-organic frameworks (Ln-MOFs can adopt a variety of new structures due to the large coordination numbers of Ln metal ions, and Ln-MOFs are expected to show new luminescence and magnetic properties due to the localized f electrons. In particular, some Ln metal ions, such as Dy(III and Tb(III ions, work as isolated quantum magnets when they have magnetic anisotropy. In this work, using 4,4′,4″-s-triazine-2,4,6-triyl-tribenzoic acid (H3TATB as a ligand, two new Ln-MOFs, [Dy(TATB(DMF2] (1 and [Tb(TATB(DMF2] (2, were obtained. The Ln-MOFs contain Ln dinuclear clusters as secondary building units, and 1 underwent slow magnetic relaxation similar to single-molecule magnets.
Poveda, Ana [Universidad Autonoma de Madrid, Servicio Interdepartamental de Investigacion (Spain); Asensio, Juan Luis; Martin-Pastor, Manuel; Jimenez-Barbero, Jesus [Instituto de Quimica Organica, CSIC, Grupo de Carbohidratos (Spain)
1997-07-15
{sup 1}H-NMR cross-relaxation rates and nonselective longitudinal relaxation times have been obtained at two magnetic fields (7.0 and 11.8 T) and at a variety of temperatures for the branched tetrasaccharide methyl 3-O-{alpha}-N-acetyl-galactosaminyl-{beta}-galactopyranosyl-(1{sup {yields}}4)[3-O-{alpha}-fucosyl] -glucopyranoside (1), an inhibitor of astrocyte growth. In addition, {sup 13}C-NMR relaxation data have also been recorded at both fields. The {sup 1}H-NMR relaxation data have been interpreted using different motional models to obtain proton-proton correlation times. The results indicate that the GalNAc and Fuc rings display more extensive local motion than the two inner Glc and Gal moieties, since those present significantly shorter local correlation times. The{sup 13}C-NMR relaxation parameters have been interpreted in terms of the Lipari-Szabo model-free approach. Thus, order parameters and internal motion correlation times have been deduced. As obtained for the{sup 1}H-NMR relaxation data, the two outer residues possess smaller order parameters than the two inner rings. Internal correlation times are in the order of 100 ps. The hydroxymethyl groups have also different behaviour,with the exocyclic carbon on the glucopyranoside unit showing the highestS{sup 2}. Molecular dynamics simulations using a solvated system have also been performed and internal motion correlation functions have been deduced from these calculations. Order parameters and interproton distances have been compared to those inferred from the NMR measurements. The obtained results are in fair agreement with the experimental data.
Kurauskas, Vilius; Weber, Emmanuelle; Hessel, Audrey; Ayala, Isabel; Marion, Dominique; Schanda, Paul
2016-09-01
Transverse relaxation rate measurements in magic-angle spinning solid-state nuclear magnetic resonance provide information about molecular motions occurring on nanosecond-to-millisecond (ns-ms) time scales. The measurement of heteronuclear ((13)C, (15)N) relaxation rate constants in the presence of a spin-lock radiofrequency field (R1ρ relaxation) provides access to such motions, and an increasing number of studies involving R1ρ relaxation in proteins have been reported. However, two factors that influence the observed relaxation rate constants have so far been neglected, namely, (1) the role of CSA/dipolar cross-correlated relaxation (CCR) and (2) the impact of fast proton spin flips (i.e., proton spin diffusion and relaxation). We show that CSA/D CCR in R1ρ experiments is measurable and that the CCR rate constant depends on ns-ms motions; it can thus provide insight into dynamics. We find that proton spin diffusion attenuates this CCR due to its decoupling effect on the doublet components. For measurements of dynamics, the use of R1ρ rate constants has practical advantages over the use of CCR rates, and this article reveals factors that have so far been disregarded and which are important for accurate measurements and interpretation.
Flow restrictive and shear reducing effect of magnetization relaxation in ferrofluid cavity flow
Singh, Chamkor; Das, Arup Kumar; Das, Prasanta Kumar
2016-08-01
In this study, we report the effects of a uniform stationary magnetic field on the flow of ferrofluid (FF) inside a boundary driven cavity. A coupled set of conservation equations for the flow field, the Maxwell's magnetostatic equations, and the constitutive magnetization equation are solved numerically. The non-dimensional groups primarily influencing the phenomenon are first systematically identified through the normalization of the complete set of equations. We find the magnetization relaxation effects, under the stationary uniform field, to be flow restrictive in nature. The misalignment between the local magnetic field and the magnetization suppresses the vorticity field in the cavity, shifts the primary central vortex, and reduces the average shear stress at the boundaries. As a consequence, it becomes apparent that at a given Reynolds number, the application of uniform magnetic field can reduce the shear drag at the boundaries of the cavity, of course at an expense of reduced flow rate in their vicinity. Our study uniquely reveals that the relaxation time effects are dominant in the regions of ferrofluid flow where the change in the magnitude of the vorticity takes place over a length scale which is much smaller than the characteristic length scale of the flow geometry. Depending on the magnitudes of influencing parameters, the solution exhibits anomalous characteristics, such as creeping and saturating behavior.
Spin relaxation of a short-lived radical in zero magnetic field.
McKenzie, Iain
2011-01-21
A short-lived radical containing only one I = 1/2 nucleus, the muoniated 1,2-dicarboxyvinyl radical dianion, was produced in an aqueous solution by the reaction of muonium with the dicarboxyacetylene dianion. The identity of the radical was confirmed by measuring the muon hyperfine coupling constant (hfcc) by transverse field muon spin rotation spectroscopy and comparing this value with the hfcc obtained from DFT calculations. The muon spin relaxation rate of this radical was measured as a function of temperature in zero magnetic field by the zero field muon spin relaxation technique. The results have been interpreted using the theoretical model of Fedin et al. (J. Chem. Phys., 2003, 118, 192). The muon spin polarization decreases exponentially with time after muon implantation and the temperature dependence of the spin relaxation rate indicates that the dominant relaxation mechanism is the modulation of the anisotropic hyperfine interaction due to molecular rotation. The effective radius of the radical in solution was determined to be 1.12 ± 0.04 nm from the dependence of the muon spin relaxation rate on the temperature and viscosity of the solution, and is approximately 3.6 times larger than the value obtained from DFT calculations.
The effect of rough surfaces on Nuclear Magnetic Resonance relaxation experiments
Nordin, Matias
2015-01-01
Most theoretical treatments of Nuclear Magnetic Resonance (NMR) assume ideal smooth geometries (i.e. slabs, spheres or cylinders) with well-defined surface-to-volume ratios (S/V). This same assumption is commonly adopted for naturally occurring materials, where the pore geometry can differ substantially from these ideal shapes. In this paper the effect of surface roughness on the T2 relaxation spectrum is studied. By homogenization of the problem using an electrostatic approach it is found that the effective surface relaxivity can increase dramatically in the presence of rough surfaces. This leads to a situation where the system responds as a smooth pore, but with significantly increased surface relaxivity. As a result: the standard approach of assuming an idealized geometry with known surface-to-volume and inverting the T2 relaxation spectrum to a pore size distribution is no longer valid. The effective relaxivity is found to be fairly insensitive to the shape of roughness but strongly dependent on the width...
Energy-resolved hot carrier relaxation dynamics in monocrystalline plasmonic nanoantennas
Méjard, Régis; Petit, Marlène; Bouhelier, Alexandre; Cluzel, Benoît; Demichel, Olivier
2016-01-01
Hot carriers are energetic photo-excited carriers driving a large range of chemico-physical mechanisms. At the nanoscale, an efficient generation of these carriers is facilitated by illuminating plasmonic antennas. However, the ultrafast relaxation rate severally impedes their deployment in future hot-carrier based devices. In this paper, we report on the picosecond relaxation dynamics of hot carriers in plasmonic monocrystalline gold nanoantennas. The temporal dynamics of the hot carriers is experimentally investigated by interrogating the nonlinear photoluminescence response of the antenna with a spectrally-resolved two-pulse correlation configuration. We measure time-dependent nonlinearity orders varying from 1 to 8, which challenge the common interpretation of multi-photon gold luminescence. We demonstrate that the relaxation of the photo-excited carriers depends of their energies relative to the Fermi level. We find a 60 % variation in the relaxation rate for electron-hole pair energies ranging from c.a....
Dynamically controlled energy dissipation for fast magnetic vortex switching
Badea, R.; Berezovsky, J.
2017-09-01
Manipulation of vortex states in magnetic media provides new routes towards information storage and processing technology. The typical slow relaxation times (˜100 ns) of magnetic vortex dynamics may present an obstacle to the realization of these applications. Here, we investigate how a vortex state in a ferromagnetic microdisk can be manipulated in a way that translates the vortex core while enhancing energy dissipation to rapidly damp the vortex dynamics. We use time-resolved differential magneto-optical Kerr effect microscopy to measure the motion of the vortex core in response to applied magnetic fields. We first map out how the vortex core becomes sequentially trapped by pinning sites as it translates across the disk. After applying a fast magnetic field step to translate the vortex from one pinning site to another, we observe long-lived dynamics of the vortex as it settles to the new equilibrium. We then demonstrate how the addition of a short (magnetic field pulse can induce additional energy dissipation, strongly damping the long-lived dynamics. A model of the vortex dynamics using the Thiele equation of motion explains the mechanism behind this effect.
Magnetic properties, water proton relaxivities, and in-vivo MR images of paramagnetic nanoparticles
Lee, Gang Ho; Chang, Yongmin
2015-07-01
In this mini review, magnetic resonance imaging (MRI) contrast agents based on lanthanideoxide (Ln2O3) nanoparticles are described. Ln2O3 (Ln = Gd, Dy, Ho, and Er) nanoparticles are paramagnetic, but show appreciable magnetic moments at room temperature and even at ultrasmall particle diameters. Among Ln2O3 nanoparticles, Gd2O3 nanoparticles show larger longitudinal water proton relaxivity (r1) values than Gd-chelates because of the large amount of Gd in the nanoparticle, and the other Ln2O3 nanoparticles (Ln = Dy, Ho, and Er) show appreciable transverse water proton relaxivity (r2) values. Therefore, Gd2O3 nanoparticles are potential T1 MRI contrast agents while the other Ln2O3 nanoparticles are potential T2 MRI contrast agents at high MR fields.
Wu, Xuebang; Guo, Lijun; Liu, C. S.
2014-06-01
The dynamics of the Johari-Goldstein (JG) β relaxation and the α relaxation in bulk metallic glasses (MGs) has been investigated by using mechanical spectroscopy combined with the Coupling Model. The β relaxations of MGs exhibit different behaviors such as peaks, humps, and excess wings due to the different fluctuations of the chemical interactions among the constituting atoms. A universal correlation between the β relaxation and the α relaxation is generally found by their activation energies and relaxation times as well as the non-exponentiality parameter of the α relaxation, which can be predicted quantitatively from the Coupling Model. Based on the quasi-point defects theory, a correlation factor χ shows a broad peak along with the β relaxation, suggesting that the concentration and the correlation degree of the string-like configurations involved in the β relaxation vary with increasing temperature, which challenges the previous view that the system is in an iso-configuration state below Tg and may shed new light on the nature of the JG β relaxation in metallic glasses.
Langley, Stuart K; Chilton, Nicholas F; Moubaraki, Boujemaa; Murray, Keith S
2013-06-17
Three new heterometallic complexes with formulas of [Dy(III)2Co(III)2(OMe)2(teaH)2(acac)4(NO3)2] (1), [Dy(III)2Co(III)2(OH)2(teaH)2(acac)4(NO3)2]·4H2O (2), and [Dy(III)2Co(III)2(OMe)2(mdea)2(acac)4(NO3)2] (3) were characterized by single-crystal X-ray diffraction and by dc and ac magnetic susceptibility measurements. All three complexes have an identical "butterfly"-type metallic core that consists of two Dy(III) ions occupying the "body" position and two diamagnetic low-spin Co(III) ions occupying the outer "wing-tips". Each complex displays single-molecule magnet (SMM) behavior in zero applied magnetic field, with thermally activated anisotropy barriers of 27, 28, and 38 K above 7.5 K for 1-3, respectively, as well as observing a temperature-independent mechanism of relaxation below 5 K for 1 and 2 and at 3 K for 3, indicating fast quantum tunneling of magnetization (QTM). A second, faster thermally activated relaxation mechanism may also be active under a zero applied dc field as derived from the Cole-Cole data. Interestingly, these complexes demonstrate further relaxation modes that are strongly dependent upon the application of a static dc magnetic field. Dilution experiments that were performed on 1, in the {Y(III)2Co(III)2} diamagnetic analog, show that the slow magnetic relaxation is of a single-ion origin, but it was found that the neighboring ion also plays an important role in the overall relaxation dynamics.
Zhang Xingyi; Zhou Jun; Zhou Youhe [Key Laboratory of Mechanics on Western Disaster and Environment, Ministry of Education (China); Liang Xinwen [Department of Finance, School of Economics of Sichuan University, Sichuan University, Chengdu, Sichuan 610064 (China)
2009-02-15
We present an experimental study of the relaxation of vertical and horizontal force components in an unsymmetrical high-temperature superconducting levitation system, with different initial cooling processes, after fixing the levitated body statically in a given position. It was found that the values of the relaxation measurements of the levitation force and lateral force remained constant or increased with time after vertical and horizontal traverses. The phenomenon has been theoretically described based on the Bean model and the thermally activated flux creep theory. The criterion developed in the present work is considered to be suitable for providing qualitative predictions of the relaxation properties in the levitation force and lateral force.
Zhang, Xing-Yi; Zhou, Jun; Zhou, You-He; Liang, Xin-Wen
2009-02-01
We present an experimental study of the relaxation of vertical and horizontal force components in an unsymmetrical high-temperature superconducting levitation system, with different initial cooling processes, after fixing the levitated body statically in a given position. It was found that the values of the relaxation measurements of the levitation force and lateral force remained constant or increased with time after vertical and horizontal traverses. The phenomenon has been theoretically described based on the Bean model and the thermally activated flux creep theory. The criterion developed in the present work is considered to be suitable for providing qualitative predictions of the relaxation properties in the levitation force and lateral force.
Konuma, Tsuyoshi [Icahn School of Medicine at Mount Sinai, Department of Structural and Chemical Biology (United States); Harada, Erisa [Suntory Foundation for Life Sciences, Bioorganic Research Institute (Japan); Sugase, Kenji, E-mail: sugase@sunbor.or.jp, E-mail: sugase@moleng.kyoto-u.ac.jp [Kyoto University, Department of Molecular Engineering, Graduate School of Engineering (Japan)
2015-12-15
Protein dynamics plays important roles in many biological events, such as ligand binding and enzyme reactions. NMR is mostly used for investigating such protein dynamics in a site-specific manner. Recently, NMR has been actively applied to large proteins and intrinsically disordered proteins, which are attractive research targets. However, signal overlap, which is often observed for such proteins, hampers accurate analysis of NMR data. In this study, we have developed a new methodology called relaxation dispersion difference that can extract conformational exchange parameters from overlapped NMR signals measured using relaxation dispersion spectroscopy. In relaxation dispersion measurements, the signal intensities of fluctuating residues vary according to the Carr-Purcell-Meiboon-Gill pulsing interval, whereas those of non-fluctuating residues are constant. Therefore, subtraction of each relaxation dispersion spectrum from that with the highest signal intensities, measured at the shortest pulsing interval, leaves only the signals of the fluctuating residues. This is the principle of the relaxation dispersion difference method. This new method enabled us to extract exchange parameters from overlapped signals of heme oxygenase-1, which is a relatively large protein. The results indicate that the structural flexibility of a kink in the heme-binding site is important for efficient heme binding. Relaxation dispersion difference requires neither selectively labeled samples nor modification of pulse programs; thus it will have wide applications in protein dynamics analysis.
Fang, Jiancheng; Wang, Tao; Quan, Wei; Yuan, Heng; Zhang, Hong; Li, Yang; Zou, Sheng
2014-06-01
A novel method to compensate the residual magnetic field for an atomic magnetometer consisting of two perpendicular beams of polarizations was demonstrated in this paper. The method can realize magnetic compensation in the case where the pumping rate of the probe beam cannot be ignored. In the experiment, the probe beam is always linearly polarized, whereas, the probe beam contains a residual circular component due to the imperfection of the polarizer, which leads to the pumping effect of the probe beam. A simulation of the probe beam's optical rotation and pumping rate was demonstrated. At the optimized points, the wavelength of the probe beam was optimized to achieve the largest optical rotation. Although, there is a small circular component in the linearly polarized probe beam, the pumping rate of the probe beam was non-negligible at the optimized wavelength which if ignored would lead to inaccuracies in the magnetic field compensation. Therefore, the dynamic equation of spin evolution was solved by considering the pumping effect of the probe beam. Based on the quasi-static solution, a novel magnetic compensation method was proposed, which contains two main steps: (1) the non-pumping compensation and (2) the sequence compensation with a very specific sequence. After these two main steps, a three-axis in situ magnetic compensation was achieved. The compensation method was suitable to design closed-loop spin-exchange relaxation-free magnetometer. By a combination of the magnetic compensation and the optimization, the magnetic field sensitivity was approximately 4 fT/Hz(1/2), which was mainly dominated by the noise of the magnetic shield.
Zhao, Jiong-Peng; Zhao, Ran; Yang, Qian; Hu, Bo-Wen; Liu, Fu-Chen; Bu, Xian-He
2013-10-28
Two M(II) tetranuclear complexes bridged only by azido, Mn4(N3)(7.3)Cl(0.7)L4 (1) and Co4(N3)8L4 (2) in which the four M(II) ions are precisely coplanar bridged only by six azido anions, were obtained by using 4,5-diazafluoren-9-one (L) as a corner ligand. Magnetic studies indicate that ferromagnetic coupling was conducted by the azido anions between M(II) ions. At low temperature, 1 exhibits a large magnetocaloric effect and 2 shows field-induced multiple magnetic relaxations.
Habib, Fatemah; Luca, Oana R; Vieru, Veacheslav; Shiddiq, Muhandis; Korobkov, Ilia; Gorelsky, Serge I; Takase, Michael K; Chibotaru, Liviu F; Hill, Stephen; Crabtree, Robert H; Murugesu, Muralee
2013-10-18
The electronic and magnetic properties of the complexes [Co(terpy)Cl2 ] (1), [Co(terpy)(NCS)2 ] (2), and [Co(terpy)2 ](NCS)2 (3) were investigated. The coordination environment around Co(II) in 1 and 2 leads to a high-spin complex at low temperature and single-molecule magnet properties with multiple relaxation pathways. Changing the ligand field and geometry with an additional terpy ligand leads to spin-crossover behavior in 3 with a gradual transition from high spin to low spin.
Slow magnetic relaxation at zero field in the tetrahedral complex [Co(SPh)4]2-.
Zadrozny, Joseph M; Long, Jeffrey R
2011-12-28
The Ph(4)P(+) salt of the tetrahedral complex [Co(SPh)(4)](2-), possessing an S = (3)/(2) ground state with an axial zero-field splitting of D = -70 cm(-1), displays single-molecule magnet behavior in the absence of an applied magnetic field. At very low temperatures, ac magnetic susceptibility data show the magnetic relaxation time, τ, to be temperature-independent, while above 2.5 K thermally activated Arrhenius behavior is apparent with U(eff) = 21(1) cm(-1) and τ(0) = 1.0(3) × 10(-7) s. Under an applied field of 1 kOe, τ more closely approximates Arrhenius behavior over the entire temperature range. Upon dilution of the complex within a matrix of the isomorphous compound (Ph(4)P)(2)[Zn(SPh)(4)], ac susceptibility data reveal the molecular nature of the slow magnetic relaxation and indicate that the quantum tunneling pathway observed at low temperatures is likely mediated by intermolecular dipolar interactions.
Size dependence of the magnetic relaxation and specific power absorption in iron oxide nanoparticles
Lima, E. [CONICET and Instituto de Nanociencia y Nanotecnologia and Centro Atomico Bariloche (Argentina); Torres, T. E. [University of Zaragoza, Instituto de Nanociencia de Aragon (INA) and Departamento de Fisica de la Materia Condensada and Laboratorio de Microscopias Avanzadas (LMA) (Spain); Rossi, L. M. [Instituto de Quimica, Universidade de Sao Paulo (Brazil); Rechenberg, H. R. [Instituto de Fisica, Universidade de Sao Paulo (Brazil); Berquo, T. S. [Institute of Rock Magnetism, University of Minnesota (United States); Ibarra, A. [University of Zaragoza, INA and LMA (Spain); Marquina, C. [CSIC, Universidad de Zaragoza, Departamento de Fisica de la Materia Condensada and Instituto de Ciencia de Materiales de Aragon (ICMA) (Spain); Ibarra, M. R. [University of Zaragoza, INA and Departamento de Fisica de la Materia Condensada and LMA (Spain); Goya, G. F., E-mail: goya@unizar.es [University of Zaragoza, INA and Departamento de Fisica de la Materia Condensada (Spain)
2013-05-15
In this study, magnetic and power absorption properties of a series of iron oxide nanoparticles with average sizes Left-Pointing-Angle-Bracket d Right-Pointing-Angle-Bracket ranging from 3 to 23 nm were reported. The nanoparticles were prepared by thermal decomposition of Iron(III) acetylacetonate in organic media. From the careful characterization of the magnetic and physicochemical properties of these samples, the specific power absorption (SPA) values experimentally found were numerically reproduced, as well as their dependence with particle size, using a simple model of Brownian and Neel relaxation at room temperature. SPA experiments in ac magnetic fields (H{sub 0} = 13 kA/m and f = 250 kHz) indicated that the magnetic and rheological properties played a crucial role determining the heating efficiency at different conditions. A maximum SPA value of 344 W/g was obtained for a sample containing nanoparticles with Left-Pointing-Angle-Bracket d Right-Pointing-Angle-Bracket = 12 nm and dispersion {sigma} = 0.25. The observed SPA dependence with particle diameter and their magnetic parameters indicated that, for the size range and experimental conditions of f and H studied in this study, both Neel and Brown relaxation mechanisms are important to the heat generation observed.
Lin, Po-Heng; Sun, Wen-Bin; Yu, Mang-Fei; Li, Guang-Ming; Yan, Peng-Fei; Murugesu, Muralee
2011-10-21
A Dy(2) single-molecule magnet was isolated using a mixed ligand strategy in which the Dy(III) ions adopt distinct coordination environments. This leads to two unique relaxation modes due to a single-ion type relaxation mechanism. Energy barriers were obtained from individually fitting the overlapping peaks.
Williams, Ursula J; Mahoney, Brian D; DeGregorio, Patrick T; Carroll, Patrick J; Nakamaru-Ogiso, Eiko; Kikkawa, James M; Schelter, Eric J
2012-06-07
Dysprosium complexes of the tmtaa(2-) ligand were synthesized and characterized by X-band EPR and magnetism studies. Both complexes demonstrate magnetoanisotropy and slow paramagnetic relaxation. Comparison of these compounds with the seminal phthalocyanine complex [Dy(Pc)(2)](-) shows the azaannulide complexes are more susceptible to relaxation through non-thermal pathways.
Benmelouka, Meriem; Borel, Alain; Moriggi, Loick; Helm, Lothar; Merbach, André E
2007-02-01
A multiple-frequency (9.4-325 GHz) and variable-temperature (276-320 K) electron paramagnetic resonance (EPR) study on low molecular weight gadolinium(III) complexes for potential use as magnetic resonance imaging (MRI) contrast agents has been performed. Peak-to-peak linewidths Delta Hpp and central magnetic fields have been analyzed within the Redfield approximation taking into account the static zero-field splitting (ZFS) up to the sixth order and the transient ZFS up to the second order. Longitudinal electronic relaxation is dominated by the static ZFS contribution at low magnetic fields (B 1.5 T). Whereas the static ZFS clearly depends on the nature of the chelating ligand, the transient ZFS does not. For the relatively fast rotating molecules studied water proton relaxivity is mainly limited by the fast rotation and electronic relaxation has only a marked influence at frequencies below 30 MHz. From our EPR results we can conclude that electronic relaxation will have no influence on the efficiency of Gd(III)-based MRI contrast agents designed for studies at very high magnetic fields (B > 3T).
Interfacial effects revealed by ultrafast relaxation dynamics in BiFeO 3 / YBa 2 Cu 3 O 7 bilayers
Springer, D.
2016-02-12
The temperature dependence of the relaxation dynamics in the bilayer thin film heterostructure composed of multiferroic BiFeO3 (BFO) and superconducting YBa2Cu3O7 (YBCO) grown on a (001) SrTiO3 substrate is studied by a time-resolved pump-probe technique, and compared with that of pure YBCO thin film grown under the same growth conditions. The superconductivity of YBCO is found to be retained in the heterostructure. We observe a speeding up of the YBCO recombination dynamics in the superconducting state of the heterostructure, and attribute it to the presence of weak ferromagnetism at the BFO/YBCO interface as observed in magnetization data. An extension of the Rothwarf-Taylor model is used to fit the ultrafast dynamics of BFO/YBCO, that models an increased quasiparticle occupation of the ferromagnetic interfacial layer in the superconducting state of YBCO.
Wu Xuebang
2015-09-01
Full Text Available The general trend in soft matter is to study systems of increasing complexity covering a wide range in time and frequency. Mechanical spectroscopy is a powerful tool for understanding the structure and relaxation dynamics of these materials over a large temperature range and frequency scale. In this work, we collect a few recent applications using low-frequency mechanical spectroscopy for elucidating the structural changes and relaxation dynamics in soft matter, largely based on the author’s group. We illustrate the potential of mechanical spectroscopy with three kinds of soft materials: colloids, polymers and granular systems. Examples include structural changes in colloids, segmental relaxations in amorphous polymers, and resonant dissipation of grain chains in three-dimensional media. The present work shows that mechanical spectroscopy has been applied as a necessary and complementary tool to study the dynamics of such complex systems.
Collective relaxation dynamics and crystallization kinetics of the amorphous Biclotymol antiseptic.
Tripathi, Pragya; Romanini, Michela; Tamarit, Josep Lluis; Macovez, Roberto
2015-11-10
We employ dielectric spectroscopy to monitor the relaxation dynamics and crystallization kinetics of the Biclotymol antiseptic in its amorphous phase. The glass transition temperature of the material as determined by dielectric spectroscopy is Tg = 290 ± 1K. The primary (α) relaxation dynamics is observed to follow a Vogel-Fulcher-Tammann temperature dependence, with a kinetic fragility index m = 86 ± 13, which classifies Biclotymol as a relatively fragile glass former. A secondary relaxation is also observed, corresponding to an intramolecular dynamic process of the non-rigid Biclotymol molecule. The crystallization kinetics, measured at four different temperatures above the glass transition temperature, follows an Avrami behavior with exponent virtually equal to n = 2, indicating one-dimensional crystallization into needle-like crystallites, as experimentally observed, with a time-constant nucleation rate. The activation barrier for crystallization is found to be Ea = 115 ± 22 kJ mol(-1).
Relaxation Dynamics of Ferroelectric Liquid Crystals in Pulsed Electric Field
Kudreyko, A. A.; Migranov, N. G.; Migranova, D. N.
2016-11-01
In this contribution we report a theoretical study of relaxation processes in surface-stabilized ferroelectric liquid crystals with spontaneous polarization. The influence of pulsed electric field on the behavior of ferroelectric liquid crystal in the SmC* phase, which is placed in a thin cell with strong anchoring of SmC* molecules with the boundary substrate, is studied. In the vicinity of the substrate interface, temporal dependence of the azimuthal motion of the director induced by electric field is obtained. The response to the external distortion of ferroelectric liquid crystal confined between two microstructured substrates is the occurrence of periodic temporal formation of solitons connected with the distortion of the director field n in the sample bulk. The interplay between microstructured substrates and director distribution of the ferroelectric SmC* phase is explained by the Frenkel-Kontorova model for a chain of atoms, but adapted for the continuum problem.
Electrical relaxation dynamics in TiO2 – polymer matrix composites
2007-12-01
Full Text Available Polymer matrix-TiO2 composites were prepared in three different filler concentrations. The electrical relaxation dynamics as well as the electrical conductivity of all samples were examined by means of Broadband Dielectric Spectroscopy (BDS over a wide frequency and temperature range. The recorded relaxation response includes contributions from both the polymer matrix and the reinforcing phase. Two relaxation modes (β and γ are observed in the low temperature region, which are attributed to the re-orientation of polar side groups of the matrix and rearrangement of small parts of the polymeric chain respectively. The α-relaxation and the Maxwell-Wagner-Sillars effect (MWS, attributed to the glassrubber transition of the polymeric matrix and to interfacial polarization phenomena respectively, are observed in the high temperature region. These two mechanisms are superimposed, thus a computer simulation procedure was followed in order to distinguish them. MWS effect becomes more pronounced with increasing concentration of the filler following an Arrhenius behaviour. The relaxation frequencies corresponding to α-mode follow the Vogel-Tamann-Fulcher (VTF equation. An additional relaxation mode is recorded at relatively high temperatures and high frequencies. Its occurrence and dynamics are related to the presence and the concentration of the filler. Finally, the Direct Current (DC conductivity follows the VTF equation.
Magnetic spectra and Richter aftereffect relaxation in CexY3−xFe5O12 ferrites
Fu Chen
2016-05-01
Full Text Available The static and dynamic magnetic properties of cerium (Ce doped yttrium iron garnet CexY3−xFe5O12 (x=0, 0.05, 0.1, 0.15, 0.2 ferrites (YIG have been reported in this work. The ferrites were fabricated by the traditional solid-state reaction method. All ferrite samples reveal pure garnet structure identified by x-ray diffraction (XRD. The substitution of cerium not only enhances the saturation magnetization of the samples, but also regulates the magnetocrystalline anisotropy constant K1. Obvious differences in permeability spectra over a frequency of 1 MHz - 1 GHz can be observed. It is verified that the permeability dispersion and magnetic losses of Ce-doped YIG ferrite contain the contribution of Richter aftereffect relaxation due to the existence of Fe2+ ions. The fitting results of the permeability spectra applied three-mechanism model is in good agreement with experimental data, which successfully explains the mechanisms of magnetic losses observed at 1 MHz to 1 GHz for Ce-doped YIG ferrite. In addition, the frequency shift of Richter aftereffect has also been discussed.
Relaxation dynamics of a quantum emitter resonantly coupled to a metal nanoparticle
Nerkararyan, K. V.; Bozhevolnyi, S. I.
2014-01-01
The presence of a metal nanoparticle (MNP) near a quantum dipole emitter, when a localized surface plasmon mode is excited via the resonant coupling with an excited quantum dipole, dramatically changes the relaxation dynamics: an exponential decay changes to step-like behavior. The main physical...... consequence of this relaxation process is that the emission, being largely determined by the MNP, comes out with a substantial delay. A large number of system parameters in our analytical description opens new possibilities for controlling quantum emitter dynamics. (C) 2014 Optical Society of America...
Molecular Dynamics Simulation on Charge Transfer Relaxation between Myoglobin and Water
CHENG Wei; ZHANG Feng-Shou; ZHANG Bo-Yang; ZHOU Hong-Yu
2007-01-01
Dynamical processes of myoglobin after photon-excited charge transfer between Fe ion and surrounding water anion ale simulated by a molecular dynamics model.The roles of Coulomb interaction effect and water effect in the relaxation process are discussed.It is found that the relaxations before and after charge transfer are similar.Strong Coulomb interactions and less water mobility decrease Coulomb energy fluctuations.An extra transferred charge of Fe ion has impact on water packing with a distance up to 0.86nm.
Ultrafast Relaxation Dynamics of Photoexcited Zinc-Porphyrin: Electronic-Vibrational Coupling.
Abraham, Baxter; Nieto-Pescador, Jesus; Gundlach, Lars
2016-08-18
Cyclic tetrapyrroles are the active core of compounds with crucial roles in living systems, such as hemoglobin and chlorophyll, and in technology as photocatalysts and light absorbers for solar energy conversion. Zinc-tetraphenylporphyrin (Zn-TPP) is a prototypical cyclic tetrapyrrole that has been intensely studied in past decades. Because of its importance for photochemical processes the optical properties are of particular interest, and, accordingly, numerous studies have focused on light absorption and excited-state dynamics of Zn-TPP. Relaxation after photoexcitation in the Soret band involves internal conversion that is preceded by an ultrafast process. This relaxation process has been observed by several groups. Hitherto, it has not been established if it involves a higher lying "dark" state or vibrational relaxation in the excited S2 state. Here we combine high time resolution electronic and vibrational spectroscopy to show that this process constitutes vibrational relaxation in the anharmonic S2 potential.
Singh, Navneet; Agarwal, Ashish; Sanghi, Sujata; Khasa, Satish
2012-08-01
The dielectric properties, dc and ac electrical resistivities of Mg substituted Ni-Cu ferrites with general formula Ni0.5Cu0.5-xMgxFe2O4 (0.0≤x≤0.5) have been investigated as a function of frequency, temperature and composition. ac resistivity of all the samples decreases with increase in the frequency exhibiting normal ferrimagnetic behavior. The frequency dependence of dielectric loss tangent showed a maximum in between 10 Hz and 1 kHz in all the ferrites. The conductivity relaxation of the charge carriers was examined using the electrical modulus formulism, and the results indicate the presence of the non-Debye type of relaxation in the prepared ferrites. Similar values of activation energies for dc conduction and for conductivity relaxation reveal that the mechanism of electrical conduction and dielectric polarization is the same in these ferrites. A single 'master curve' for normalized plots of all the modulus isotherms observed for a given composition indicates that the distribution of relaxation time is temperature independent. The saturation magnetization and coercivity as calculated from the hysteresis loop measurement show striking dependence on composition.
Relaxation study of cement based grouting material using nuclear magnetic resonance
Li Xianzhong; Lin Baiquan; Zhai Cheng; Ni Guanhua; Li Ziwen
2012-01-01
Aiming at actual condition of poor effect of hole sealing for the reason of poor cement paste fluidity in the process of coal mine gas drainage,by adding a water reducing agent,cement paste for hole sealing was produced.The changes of initial distribution,weighted average values and total relaxation signal intensity of transverse relaxation time (T2) of water in pure cement paste and water reducing agent added cement paste were studied with low field proton nuclear magnetic resonance (NMR).The results show that there are four peaks in T2 distribution curves of cement paste:the first peak is related to the bound water in flocculation,the second and the third peaks are related to the water in flocculation,water reducing agent makes it extending towards the long relaxation time,increasing its liquidity,and the fourth peak is related to the free water.By using weighted average values of T2 and total relaxation signal intensity,hydration process of cement pastes could be roughly divided into four stages:the initial period,reaction period,accelerated period and steady period.By analyzing the periods,it makes sure that the grouting process should be completed in the reaction period in the site,and the drainage process should be started in the steady period.The results have great guiding significance to the hole sealing and methane drainage.
Relaxation study of cement based grouting material using nuclear magnetic resonance
Li; Xianzhong; Lin; Baiquan; Zhai; Cheng; Ni; Guanhua; Li; Ziwen
2012-01-01
Aiming at actual condition of poor effect of hole sealing for the reason of poor cement paste fluidity in the process of coal mine gas drainage,by adding a water reducing agent,cement paste for hole sealing was produced.The changes of initial distribution,weighted average values and total relaxation signal intensity of transverse relaxation time(T 2) of water in pure cement paste and water reducing agent added cement paste were studied with low field proton nuclear magnetic resonance(NMR).The results show that there are four peaks in T2 distribution curves of cement paste:the first peak is related to the bound water in flocculation,the second and the third peaks are related to the water in flocculation,water reducing agent makes it extending towards the long relaxation time,increasing its liquidity,and the fourth peak is related to the free water.By using weighted average values of T2 and total relaxation signal intensity,hydration process of cement pastes could be roughly divided into four stages:the initial period,reaction period,accelerated period and steady period.By analyzing the periods,it makes sure that the grouting process should be completed in the reaction period in the site,and the drainage process should be started in the steady period.The results have great guiding significance to the hole sealing and methane drainage.
Malliavin, T. E.; Desvaux, H.; Aumelas, A.; Chavanieu, A.; Delsuc, M. A.
1999-09-01
We describe a quantitative processing method which gives access to the longitudinal and transverse cross-relaxation rates from off-resonance ROESY intensities. This method takes advantage of the dependence of the off-resonance ROESY experiments at any mixing time and any spin-lock angle θ on two relaxation matrices, the longitudinal and the transverse ones. This allows one to take into account multistep magnetization transfers even if the measurements are performed only at one or two mixing times. The ratio of the longitudinal to transverse cross-relaxation rates can then be used as a local indicator of the internal dynamics, without assuming a structure or a model of motion. After validation of this processing method by numerical simulations, it is applied to the analysis of the dynamics of the peptide ranalexin dissolved in pure water and in water/TFE.
Faux, D. A.; McDonald, P. J.; Howlett, N. C.
2017-03-01
Nuclear-magnetic-resonance (NMR) relaxation experimentation is an effective technique for nondestructively probing the dynamics of proton-bearing fluids in porous media. The frequency-dependent relaxation rate T1-1 can yield a wealth of information on the fluid dynamics within the pore provided data can be fit to a suitable spin diffusion model. A spin diffusion model yields the dipolar correlation function G (t ) describing the relative translational motion of pairs of 1H spins which then can be Fourier transformed to yield T1-1. G (t ) for spins confined to a quasi-two-dimensional (Q2D) pore of thickness h is determined using theoretical and Monte Carlo techniques. G (t ) shows a transition from three- to two-dimensional motion with the transition time proportional to h2. T1-1 is found to be independent of frequency over the range 0.01-100 MHz provided h ≳5 nm and increases with decreasing frequency and decreasing h for pores of thickness h <3 nm. T1-1 increases linearly with the bulk water diffusion correlation time τb allowing a simple and direct estimate of the bulk water diffusion coefficient from the high-frequency limit of T1-1 dispersion measurements in systems where the influence of paramagnetic impurities is negligible. Monte Carlo simulations of hydrated Q2D pores are executed for a range of surface-to-bulk desorption rates for a thin pore. G (t ) is found to decorrelate when spins move from the surface to the bulk, display three-dimensional properties at intermediate times, and finally show a bulk-mediated surface diffusion (Lévy) mechanism at longer times. The results may be used to interpret NMR relaxation rates in hydrated porous systems in which the paramagnetic impurity density is negligible.
Cruzeiro, E. Zambrini; Tiranov, A.; Usmani, I.; Laplane, C.; Lavoie, J.; Ferrier, A.; Goldner, P.; Gisin, N.; Afzelius, M.
2017-05-01
We present a detailed study of the lifetime of optical spectral holes due to population storage in Zeeman sublevels of Nd3 +:Y2SiO5 . The lifetime is measured as a function of magnetic field strength and orientation, temperature, and Nd3 + doping concentration. At the lowest temperature of 3 K we find a general trend where the lifetime is short at low field strengths, then increases to a maximum lifetime at a few hundred mT, and then finally decays rapidly for high field strengths. This behavior can be modeled with a relaxation rate dominated by Nd3 +-Nd3 + cross relaxation at low fields and spin lattice relaxation at high magnetic fields. The maximum lifetime depends strongly on both the field strength and orientation, due to the competition between these processes and their different angular dependencies. The cross relaxation limits the maximum lifetime for concentrations as low as 30 ppm of Nd3 + ions. By decreasing the concentration to less than 1 ppm we could completely eliminate the cross relaxation, reaching a lifetime of 3.8 s at 3 K. At higher temperatures the spectral hole lifetime is limited by the magnetic-field-independent Raman and Orbach processes. In addition we show that the cross relaxation rate can be strongly reduced by creating spectrally large holes of the order of the optical inhomogeneous broadening. Our results are important for the development and design of new rare-earth-ion doped crystals for quantum information processing and narrow-band spectral filtering for biological tissue imaging.
Structure and dynamics of magnetic nanoparticles
Clausen, K.N.; Bødker, F.; Hansen, M.F.
2000-01-01
In this paper we present X-ray and neutron diffraction data illustrating aspects of crystal and magnetic structures of ferromagnetic alpha-Fe and antiferromagnetic NiO nanoparticles, as well as inelastic neutron scattering studies of the magnetic fluctuations in NiO and in canted antiferromagneti...... alpha-Fe2O3. In the inelastic case we make use of the fact that we can study both the superparamagnetic relaxation and collective magnetic excitations of the whole particle moment at the antiferromagnetic Bragg positions. (C) 2000 Elsevier Science B.V. All rights reserved....
Electron spin relaxation can enhance the performance of a cryptochrome-based magnetic compass sensor
Kattnig, Daniel R; Sowa, Jakub K; Solov'yov, Ilia A
2016-01-01
The radical pair model of the avian magnetoreceptor relies on long-lived electron spin coherence. Dephasing, resulting from interactions of the spins with their fluctuating environment, is generally assumed to degrade the sensitivity of this compass to the direction of the Earth's magnetic field...... to an Earth-strength magnetic field. Supported by calculations using toy radical pair models, we argue that these enhancements could be consistent with the molecular dynamics and magnetic interactions in avian cryptochromes....
Two-body relaxation in modified Newtonian dynamics
Ciotti, L
2004-01-01
A naive extension to MOND of the standard computation of the two-body relaxation time Tb implies that Tb is comparable to the crossing time regardless of the number N of stars in the system. This computation is questionable in view of the non-linearity of MOND's field equation. A non-standard approach to the calculation of Tb is developed that can be extended to MOND whenever discreteness noise generates force fluctuations that are small compared to the mean-field force. It is shown that this approach yields standard Newtonian results for systems in which the mean density profile is either plane-parallel or spherical. In the plane-parallel case we find that in the deep-MOND regime Tbb scales with N as in the Newtonian case, but is shorter by the square of the factor by which MOND enhances the gravitational force over its Newtonian value for the same system. Application of these results to dwarf galaxies and groups and clusters of galaxies reveals that in MOND luminosity segregation should be far advanced in g...
Stellar Dynamics around a Massive Black Hole II: Resonant Relaxation
Sridhar, S
2015-01-01
We present a first-principles theory of Resonant Relaxation (RR) of stellar systems orbiting within the sphere of influence of massive black holes in galactic nuclei. We extend the rigorous kinetic theory of Gilbert (1968) to include the Keplerian field of a black hole of mass $M_\\bullet$, and specialize to a (Keplerian) stellar system of mass $M \\ll M_\\bullet$. Using the results of the secular collisionless theory of Paper I, we orbit-average the kinetic equation through perturbative development in the small parameter $\\varepsilon = M/M_\\bullet$. This is supplemented with contributions from general relativistic corrections up to 1.5 post-Newtonian order and external gravitational sources. The result is a kinetic equation for a secular distribution function (DF) in 5-dim (Gaussian Ring) space, with explicit forms for the fluctuation and dissipation components of the collision integral. For general DFs, both apsidal and nodal precessions contribute to RR; so the traditional, physically-motivated distinction be...
Magnetic correlations in La(2-x)Sr(x)CuO4 from NQR relaxation and specific heat
Borsa, F.; Rigamonti, A.
1991-01-01
La-139 and Cu-63 Nuclear Quadrupole Resonance (NQR) relaxation measurements in La(2-x)Sr(x)CuO4 for x ranging from 0 up to 0.3, with particular emphasis on the effect of doping on the Cu(2+) magnetic correlations and dynamics, are reviewed. In the low doping limit, x less than or equal to 0.05, the results can be interpreted consistently in terms of a simple phenomenological 'two-fluids' model whereby the effect of thermally-activated mobile O(2p) holes is the one of disrupting locally the Cu(2+) spin correlations. For x greater than or equal to 0.1, the results indicate the onset, as T approaches T(sub c)(+), of a strong coupling between Cu(2+) spins and the Fermi liquid of O(2p) holes leading to the apparent disappearance of localized Cu(2+) moment in connection with the opening of a superconducting gap.
Fehr, Matthias; Behrends, Jan; Schnegg, Alexander; Lips, Klaus; Rech, Bernd [Helmholtz-Zentrum Berlin, Silizium Photovoltaik, Berlin (Germany); Astakhov, Oleksander; Finger, Friedhelm [Forschungszentrum Juelich (Germany). IEF-5 Photovoltaik
2009-07-01
We have investigated the influence of paramagnetic states on electronic transport processes in thin-film pin solar cells with pulsed Electrically Detected Magnetic Resonance (pEDMR) at X-Band frequency and low temperature (10 K). The solar cells consist of an intrinsic microcrystalline absorber layer and amorphous or microcrystalline n/p contacting layers. In addition to the identification of the participating paramagnetic centres by their g-factors, pEDMR can be used to study the dynamics of the electronic processes in detail. We present measurements of modified EPR pulse sequences in order to identify the dominating relaxation mechanisms within correlated solid-state spin-pairs. By this technique a monitoring of the spin and charge motion is possible. In the outlook we present measurements of the electron spin echo envelope and critically discuss modulations in terms of dipolar coupling within the spin-pairs or hyperfine couplings to surrounding nuclei.
Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Gaudisson, Thomas; François, Michel
2012-03-05
Reported here are the synthesis and structural and topological analysis as well as a magnetic investigation of the new Co(4)(OH)(2)(C(10)H(16)O(4))(3) metal-organic framework. The structural analysis reveals a one-dimensional inorganic subnetwork based on complex chains of cobalt(II) ions in two different oxygen environments. Long alkane dioic acid molecules bridge these inorganic chains together to afford large distances and poor magnetic media between dense spin chains. The thermal dependence of the χT product provides evidence for uncompensated antiferromagnetic interactions within the cobaltous chains. In zero-field, dynamic magnetic susceptibility measurements show slow magnetic relaxation below 5.4 K while both neutron diffraction and heat capacity measurements give evidence of long-range order (LRO) below this temperature. The slow dynamics may originate from the motion of broad domain walls and is characterized by an Arrhenius law with a single energy barrier Δ(τ)/k(B) = 67(1) K for the [10-5000 Hz] frequency range. Moreover, in nonzero dc fields the ac susceptibility signal splits into a low-temperature frequency-dependent peak and a high-temperature frequency-independent peak which strongly shifts to higher temperature upon increasing the bias dc field. Heat capacity measurements have been carried out for various applied field values, and the recorded C(P)(T) data are used for the calculation of the thermal variations of both the adiabatic temperature change ΔT(ad) and magnetic entropy change ΔS(m). The deduced data show a modest magnetocaloric effect at low temperature. Its maximum moves up to higher temperature upon increasing the field variation, in relation with the field-sensibility of the intrachain magnetic correlation length.
How Stokes Shift Relaxation Reports on Poincar\\'e Recurrences in Host Dynamics
Mazur, Alexey K
2016-01-01
Recently it has been revealed that the equilibrium hydrogen-bond breathing dynamics of terminal base pairs in short DNA exhibit a power-law relaxation similar to that in the time-resolved Stokes shift experiments with an intercalated coumarin probe. Here a simple theory is proposed that relates the Stokes shift signal to the statistics of Poincar\\'e recurrences in the base-pair breathing. This theory can explain the origin of the observed slow non-exponential relaxation in time-resolved Stokes shift data for DNA as well as other complex systems. It turns out that an intercalated coumarin greatly increases the breathing fluctuations in the neighboring base pairs. This motion is qualitatively similar to that in terminal residues, with the same exponent in the power-law relaxation decay. The breathing dynamics is transmitted to the photoprobe by direct contacts between aromatic $\\pi$ orbitals of stacked bases.
Soliton driven relaxation dynamics and universality in protein collapse
Krokhotin, Andrey; Niemi, Antti J
2011-01-01
Protein collapse can be viewed as a dynamical phase transition, during which new scales and collective variables become excited while the old ones recede and fade away. This causes formidable computational bottle-necks in approaches that are based on atomic scale scrutiny. Here we consider an effective dynamical Landau theory to model the folding process at biologically relevant time and distance scales. We reach both a substantial decrease in the execution time and improvement in the accuracy of the final configuration, in comparison to more conventional approaches. As an example we inspect the collapse of HP35 chicken villin headpiece subdomain, where there are detailed molecular dynamics simulations to compare with. We start from a structureless, unbend and untwisted initial configuration. In less than one second of wall-clock time on a single processor personal computer we consistently reach the native state with 0.5 Angstrom root mean square distance (RMSD) precision. We confirm that our folding pathways...
Spin-lattice relaxation within a dimerized Ising chain in a magnetic field
Erdem, Rıza; Gülpınar, Gül; Yalçın, Orhan; Pawlak, Andrzej
2014-07-01
A qualitative study of the spin-lattice relaxation within a dimerized Ising chain in a magnetic field is presented. We have first determined the time dependence of the deviation of the lattice distortion parameter δ Δ from the equilibrium state within framework of a technique combining the statistical equilibrium theory based on the transfer matrix method and the linear theory of irreversible thermodynamics. We have shown that the time dependence of the lattice distortion parameter is characterized by a single time constant ( τ) which diverges around the critical point in both dimerized ( Δ ≠ 0) and uniform ( Δ = 0) phase regions. When the temperature and magnetic field are fixed to certain values, the time τ depends only on exchange coupling between the spins. It is a characteristic time associated with the long wavelength fluctuations of distortion. We have also taken into account the effects of spatial fluctuations on the relaxation time using the full Landau-Ginzburg free energy functional. We have found an explicit expression for the relaxation time as a function of temperature, coupling constant and wave vector ( q) and shown that the critical mode corresponds to the case q = 0. Finally, our results are found to be in good qualitative agreement with the results obtained in recent experimental study on synchrotron x-ray scattering and muon spin relaxation in diluted material C u 1- y M g y G e O 3 where the composition y is very close to 0.0209. These results can be considered as natural extensions of some previous works on static aspects of the problem.
Effects of heat current on magnetization dynamics
Vetro, Francesco Antonio; Brechet, Sylvain; Ansermet, Jean-Philippe
The work is aimed at investigating the interplay between spin dynamics and heat currents in single-crystal Yttrium Iron Garnet (YIG). The irreversible thermodynamics for a continuous medium predicts that a thermal gradient, in the presence of magnetization waves, produces a magnetic induction field, thus a magnetic analog of the well-known Seebeck effect. Time-resolved transmission measurements revealed a change in the attenuation of magnetization waves propagating along the thermal gradient when the gradient is reversed. This magnetic damping change can be accounted for by the Magnetic Seebeck effect. In order to characterize this effect further, we have conducted studies on magnetization dynamic in YIG single crystal samples placed in various geometrical configurations, e.g. with YIG disks in which magnetic vortices might be present. Various magnetic resonance schemes were used, e.g. local probes and cavities.
Traaseth, Nathaniel J; Chao, Fa-An; Masterson, Larry R; Mangia, Silvia; Garwood, Michael; Michaeli, Shalom; Seelig, Burckhard; Veglia, Gianluigi
2012-06-01
NMR relaxation methods probe biomolecular motions over a wide range of timescales. In particular, the rotating frame spin-lock R(1ρ) and Carr-Purcell-Meiboom-Gill (CPMG) R(2) experiments are commonly used to characterize μs to ms dynamics, which play a critical role in enzyme folding and catalysis. In an effort to complement these approaches, we introduced the Heteronuclear Adiabatic Relaxation Dispersion (HARD) method, where dispersion in rotating frame relaxation rate constants (longitudinal R(1ρ) and transverse R(2ρ)) is created by modulating the shape and duration of adiabatic full passage (AFP) pulses. Previously, we showed the ability of the HARD method to detect chemical exchange dynamics in the fast exchange regime (k(ex)∼10(4)-10(5) s(-1)). In this article, we show the sensitivity of the HARD method to slower exchange processes by measuring R(1ρ) and R(2ρ) relaxation rates for two soluble proteins (ubiquitin and 10C RNA ligase). One advantage of the HARD method is its nominal dependence on the applied radio frequency field, which can be leveraged to modulate the dispersion in the relaxation rate constants. In addition, we also include product operator simulations to define the dynamic range of adiabatic R(1ρ) and R(2ρ) that is valid under all exchange regimes. We conclude from both experimental observations and simulations that this method is complementary to CPMG-based and rotating frame spin-lock R(1ρ) experiments to probe conformational exchange dynamics for biomolecules. Finally, this approach is germane to several NMR-active nuclei, where relaxation rates are frequency-offset independent. Copyright © 2012 Elsevier Inc. All rights reserved.
Dias, F.T., E-mail: fabio.dias@ufpel.edu.br [Instituto de Física e Matemática, Universidade Federal de Pelotas, Caixa Postal 354, 96010-900, Pelotas, Rio Grande do Sul (Brazil); Vieira, V.N.; Garcia, E.L. [Instituto de Física e Matemática, Universidade Federal de Pelotas, Caixa Postal 354, 96010-900, Pelotas, Rio Grande do Sul (Brazil); Wolff-Fabris, F.; Kampert, E. [Dresden High Magnetic Field Laboratory, Helmholtz-Zentrum Dresden-Rossendorf, 01314, Dresden (Germany); Gouvêa, C.P. [National Institute of Metrology, Quality and Technology (Inmetro), Material Metrology Division, 25250-020, Duque de Caxias, Rio de Janeiro (Brazil); Schaf, J. [Instituto de Física, Universidade Federal do Rio Grande do Sul, 91501-970, Porto Alegre, Rio Grande do Sul (Brazil); Obradors, X.; Puig, T. [Institut de Ciència de Materials de Barcelona, CSIC, Universitat Autònoma de Barcelona, 08193, Bellaterra (Spain); Roa, J.J. [Departamento de Ciencia de Materiales e Ingeniería Metalúrgica, Universitat Politècnica de Catalunya, 08028, Barcelona (Spain)
2016-10-15
Highlights: • Paramagnetic Meissner effect observed up to 5T in FCC and FCW measurements. • Time effects evidenced by irreversibilities between FCC and FCW measurements. • Strong time effects causing an anomalous paramagnetic relaxation. • Paramagnetic relaxation governed by different flux dynamics in different intervals. • An interpretative analysis to identify the flux dynamics in the relaxation process. - Abstract: We have studied the functional behavior of the field-cooled (FC) magnetic relaxation observed in melt-textured YBa{sub 2}Cu{sub 3}O{sub 7-δ} (Y123) samples with 30 wt% of Y{sub 2}Ba{sub 1}Cu{sub 1}O{sub 5} (Y211) phase, in order to investigate anomalous paramagnetic moments observed during the experiments. FC magnetic relaxation experiments were performed under controlled conditions, such as cooling rate and temperature. Magnetic fields up to 5T were applied parallel to the ab plane and along the c-axis. Our results are associated with the paramagnetic Meissner effect (PME), characterized by positive moments during FC experiments, and related to the magnetic flux compression into the samples. After different attempts our experimental data could be adequately fitted by an exponential decay function with different relaxation times. We discuss our results suggesting the existence of different and preferential flux dynamics governing the anomalous FC paramagnetic relaxation in different time intervals. This work is one of the first attempts to interpret this controversial effect in a simple analysis of the pinning mechanisms and flux dynamics acting during the time evolution of the magnetic moment. However, the results may be useful to develop models to explain this interesting and still misunderstood feature of the paramagnetic Meissner effect.
Multivariable dynamic ankle mechanical impedance with relaxed muscles.
Lee, Hyunglae; Krebs, Hermano Igo; Hogan, Neville
2014-11-01
Neurological or biomechanical disorders may distort ankle mechanical impedance and thereby impair locomotor function. This paper presents a quantitative characterization of multivariable ankle mechanical impedance of young healthy subjects when their muscles were relaxed, to serve as a baseline to compare with pathophysiological ankle properties of biomechanically and/or neurologically impaired patients. Measurements using a highly backdrivable wearable ankle robot combined with multi-input multi-output stochastic system identification methods enabled reliable characterization of ankle mechanical impedance in two degrees-of-freedom (DOFs) simultaneously, the sagittal and frontal planes. The characterization included important ankle properties unavailable from single DOF studies: coupling between DOFs and anisotropy as a function of frequency. Ankle impedance in joint coordinates showed responses largely consistent with a second-order system consisting of inertia, viscosity, and stiffness in both seated (knee flexed) and standing (knee straightened) postures. Stiffness in the sagittal plane was greater than in the frontal plane and furthermore, was greater when standing than when seated, most likely due to the stretch of bi-articular muscles (medial and lateral gastrocnemius). Very low off-diagonal partial coherences implied negligible coupling between dorsiflexion-plantarflexion and inversion-eversion. The directions of principal axes were tilted slightly counterclockwise from the original joint coordinates. The directional variation (anisotropy) of ankle impedance in the 2-D space formed by rotations in the sagittal and frontal planes exhibited a characteristic "peanut" shape, weak in inversion-eversion over a wide range of frequencies from the stiffness dominated region up to the inertia dominated region. Implications for the assessment of neurological and biomechanical impairments are discussed.
A study of internal energy relaxation in shocks using molecular dynamics based models
Li, Zheng, E-mail: zul107@psu.edu; Parsons, Neal, E-mail: neal.parsons@cd-adapco.com [Department of Aerospace Engineering, The Pennsylvania State University, University Park, Pennsylvania 16802 (United States); Levin, Deborah A., E-mail: deblevin@illinois.edu [Department of Aerospace Engineering, University of Illinois Urbana-Champaign, Urbana, Illinois 61801-2935 (United States)
2015-10-14
Recent potential energy surfaces (PESs) for the N{sub 2} + N and N{sub 2} + N{sub 2} systems are used in molecular dynamics (MD) to simulate rates of vibrational and rotational relaxations for conditions that occur in hypersonic flows. For both chemical systems, it is found that the rotational relaxation number increases with the translational temperature and decreases as the rotational temperature approaches the translational temperature. The vibrational relaxation number is observed to decrease with translational temperature and approaches the rotational relaxation number in the high temperature region. The rotational and vibrational relaxation numbers are generally larger in the N{sub 2} + N{sub 2} system. MD-quasi-classical trajectory (QCT) with the PESs is also used to calculate the V-T transition cross sections, the collision cross section, and the dissociation cross section for each collision pair. Direct simulation Monte Carlo (DSMC) results for hypersonic flow over a blunt body with the total collision cross section from MD/QCT simulations, Larsen-Borgnakke with new relaxation numbers, and the N{sub 2} dissociation rate from MD/QCT show a profile with a decreased translational temperature and a rotational temperature close to vibrational temperature. The results demonstrate that many of the physical models employed in DSMC should be revised as fundamental potential energy surfaces suitable for high temperature conditions become available.
Relaxation dynamics in the columnar liquid crystal phase of hard platelets
patti, A; Belli, S; van Roij, R.H.H.G.; Dijkstra, M.
2011-01-01
We perform Monte Carlo simulations to analyze the equilibrium dynamics and the long-time structural relaxation decay of columnar liquid crystals of disk-like colloidal particles. In the wake of recent studies on the columnar mesophase of hard calamitic (rod-like) colloids, we now focus on the
Carrier relaxation dynamics in InAs/InGaAlAs quantum dashes
Ryasnyanskiy, A.I.
2011-03-01
We characterize size-dependent carrier relaxation dynamics of partial laser structures containing quantum dashes by time-resolved degenerate four wave mixing between 1.2 and 1.6 ?m. © 2010 Elsevier B.V. All rights reserved.
Temperature dependence of proton NMR relaxation times at earth's magnetic field
Niedbalski, Peter; Kiswandhi, Andhika; Parish, Christopher; Ferguson, Sarah; Cervantes, Eduardo; Oomen, Anisha; Krishnan, Anagha; Goyal, Aayush; Lumata, Lloyd
The theoretical description of relaxation processes for protons, well established and experimentally verified at conventional nuclear magnetic resonance (NMR) fields, has remained untested at low fields despite significant advances in low field NMR technology. In this study, proton spin-lattice relaxation (T1) times in pure water and water doped with varying concentrations of the paramagnetic agent copper chloride have been measured from 6 to 92oC at earth's magnetic field (1700 Hz). Results show a linear increase of T1 with temperature for each of the samples studied. Increasing the concentration of the copper chloride greatly reduced T1 and reduced dependence on temperature. The consistency of the results with theory is an important confirmation of past results, while the ability of an ultra-low field NMR system to do contrast-enhanced magnetic resonance imaging (MRI) is promising for future applicability to low-cost medical imaging and chemical identification. This work is supported by US Dept of Defense Award No. W81XWH-14-1-0048 and the Robert A. Welch Foundation Grant No. AT-1877.
Relaxation dynamics of glasses along a wide stability and temperature range
Rodríguez-Tinoco, C.; Ràfols-Ribé, J.; González-Silveira, M.; Rodríguez-Viejo, J.
2016-10-01
While lots of measurements describe the relaxation dynamics of the liquid state, experimental data of the glass dynamics at high temperatures are much scarcer. We use ultrafast scanning calorimetry to expand the timescales of the glass to much shorter values than previously achieved. Our data show that the relaxation time of glasses follows a super-Arrhenius behaviour in the high-temperature regime above the conventional devitrification temperature heating at 10 K/min. The liquid and glass states can be described by a common VFT-like expression that solely depends on temperature and limiting fictive temperature. We apply this common description to nearly-isotropic glasses of indomethacin, toluene and to recent data on metallic glasses. We also show that the dynamics of indomethacin glasses obey density scaling laws originally derived for the liquid. This work provides a strong connection between the dynamics of the equilibrium supercooled liquid and non-equilibrium glassy states.
Applications and Implications of Fractional Dynamics for Dielectric Relaxation
Hilfer, R.
This article summarizes briefly the presentation given by the author at the NATO Advanced Research Workshop on "Broadband Dielectric Spectroscopy and its Advanced Technological Applications", held in Perpignan, France, in September 2011. The purpose of the invited presentation at the workshop was to review and summarize the basic theory of fractional dynamics (Hilfer, Phys Rev E 48:2466, 1993; Hilfer and Anton, Phys Rev E Rapid Commun 51:R848, 1995; Hilfer, Fractals 3(1):211, 1995; Hilfer, Chaos Solitons Fractals 5:1475, 1995; Hilfer, Fractals 3:549, 1995; Hilfer, Physica A 221:89, 1995; Hilfer, On fractional diffusion and its relation with continuous time random walks. In: Pekalski et al. (eds) Anomalous diffusion: from basis to applications. Springer, Berlin, p 77, 1999; Hilfer, Fractional evolution equations and irreversibility. In: Helbing et al. (eds) Traffic and granular flow'99. Springer, Berlin, p 215, 2000; Hilfer, Fractional time evolution. In: Hilfer (ed) Applications of fractional calculus in physics. World Scientific, Singapore, p 87, 2000; Hilfer, Remarks on fractional time. In: Castell and Ischebeck (eds) Time, quantum and information. Springer, Berlin, p 235, 2003; Hilfer, Physica A 329:35, 2003; Hilfer, Threefold introduction to fractional derivatives. In: Klages et al. (eds) Anomalous transport: foundations and applications. Wiley-VCH, Weinheim, pp 17-74, 2008; Hilfer, Foundations of fractional dynamics: a short account. In: Klafter et al. (eds) Fractional dynamics: recent advances. World Scientific, Singapore, p 207, 2011) and demonstrate its relevance and application to broadband dielectric spectroscopy (Hilfer, J Phys Condens Matter 14:2297, 2002; Hilfer, Chem Phys 284:399, 2002; Hilfer, Fractals 11:251, 2003; Hilfer et al., Fractional Calc Appl Anal 12:299, 2009). It was argued, that broadband dielectric spectroscopy might be useful to test effective field theories based on fractional dynamics.
Ultraslow dynamics and stress relaxation in the aging of a soft glassy system
Ramos, Laurence; Cipelletti, Luca
2001-01-01
We use linear rheology and multispeckle dynamic light scattering (MDLS) to investigate the aging of a gel composed of multilamellar vesicles. Light scattering data indicate rearrangement of the gel through an unusual ultraslow ballistic motion. A dramatic slowdown of the dynamics with sample age $t_{w}$ is observed for both rheology and MDLS, the characteristic relaxation time scaling as $t_{w}^{\\mu}$. We find the same aging exponent $\\mu =0.78$ for both techniques, suggesting that they probe...
Zhongliang Zu; Qi Liu; Yanming Yu; Song Gao; Shanglian Bao
2008-01-01
Driven equilibrium single pulse observation of T1(DESPOT1)is a rapid spin-lattice relaxation constant(T1)mapping technique in magnetic resonance imaging(MRI).However,DESPOT1 is very sensitive to flip angle(FA)inhomogeneity,resulting in T1 inaccuracy.Here,a five-point DESPOTl method is proposed to reduce the sensitivity to FA inhomogeneity through FA measurement and calibra-tion.Phantom and in vivo experiments are performed to validate the technique.As a result.a rapid and accurate T1 mapping is acquired by using the proposed five-point DESPOT1 method.
Teyssier, R.; Teyssier, M.; Colson, F.
1987-01-01
The differentiation between inflammatory and non inflammatory states has been performed using Nuclear Magnetic Resonance (NMR) in vitro by measuring relaxation times T/sub 1/ and T/sub 2/ in 84 synovials fluids obtained from various rheumatologic diseases. The results show that the T/sub 1//T/sub 2/ ratio is more sensitive to distinguish these two situations rather than the isolated T/sub 1/ or T/sub /2 values. In particular, high values of T/sub 1//T/sub 2/ ratio are found in septic arthritis.
Measurements of Brownian relaxation of magnetic nanobeads using planar Hall effect bridge sensors
Østerberg, Frederik Westergaard; Rizzi, Giovanni; Zardán Gómez de la Torre, T.
2013-01-01
We compare measurements of the Brownian relaxation response of magnetic nanobeads in suspension using planar Hall effect sensors of cross geometry and a newly proposed bridge geometry. We find that the bridge sensor yields six times as large signals as the cross sensor, which results in a more ac...... performed in a commercial AC susceptometer. The presented bridge sensor is, thus, a promising component in future lab-on-a-chip biosensors for detection of clinically relevant analytes, including bacterial genomic DNA and proteins....
Dynamics of Rotating, Magnetized Neutron Stars
Liebling, Steven L.
2010-01-01
Using a fully general relativistic implementation of ideal magnetohydrodynamics with no assumed symmetries in three spatial dimensions, the dynamics of magnetized, rigidly rotating neutron stars are studied. Beginning with fully consistent initial data constructed with Magstar, part of the Lorene project, we study the dynamics and stability of rotating, magnetized polytropic stars as models of neutron stars. Evolutions suggest that some of these rotating, magnetized stars may be minimally uns...
Shu, Chunying; Corwin, Frank D.; Zhang, Jianfei; Chen, Zhijian; Reid, Jonathan E.; Sun, Minghao; Xu, Wei; Sim, Jae Hyun; Wang, Chunru; Fatouros, Panos P.; Esker, Alan R.; Gibson, Harry W.; Dorn, Harry C.
2009-01-01
A new magnetic resonance imaging (MRI) contrast agent based on the trimetallic nitride templated (TNT) metallofullerene, Gd3N@C80, was synthesized by a facile method in high yield. The observed longitudinal and transverse relaxivities, r1 and r2, for water hydrogens in the presence of the water-soluble gadofullerene 2, Gd3N@C80(OH)~26(CH2CH2COOM)~16 (M = Na or H), are 207 and 282 mM-1s-1 (per C80 cage) at 2.4 T, respectively; these values are 50 times larger than those of Gd3+ poly(aminocarboxylate) complexes, such as commercial Omniscan® and Magnevist®. This high 1H relaxivity for this new hydroxylated and carboxylated gadofullerene derivative provides high signal enhancement at significantly lower Gd concentration as demonstrated by in vitro and in vivo MRI studies. Dynamic light scattering data reveal a unimodal size distribution with an average hydrodynamic radius of ca. 78 nm in pure water (pH = 7), which is significantly different from other hydroxylated or carboxylated fullerene and metallofullerene derivatives reported to date. Agarose gel infusion results indicate that the gadofullerene 2 displayed diffusion properties different from that of commercial Omniscan® and those of PEG5000 modified Gd3N@C80. The reactive carboxyl functionality present on this highly efficient contrast agent may also serve as a precursor for biomarker tissue-targeting purposes. PMID:19445504
Chiavazza, Enrico; Kubala, Eugen; Gringeri, Concetta V; Düwel, Stephan; Durst, Markus; Schulte, Rolf F; Menzel, Marion I
2013-02-01
Scalar coupling relaxation, which is usually only associated with closely resonant nuclei (e.g., (79)Br-(13)C), can be a very effective relaxation mechanism. While working on hyperpolarized [5-(13)C]glutamine, fast liquid-state polarization decay during transfer to the MRI scanner was observed. This behavior could hypothetically be explained by substantial T(1) shortening due to a scalar coupling contribution (type II) to the relaxation caused by the fast-relaxing quadrupolar (14)N adjacent to the (13)C nucleus in the amide group. This contribution is only effective in low magnetic fields (i.e., less than 800 μT) and prevents the use of molecules bearing the (13)C-amide group as hyperpolarized MRS/MRI probes. In the present work, this hypothesis is explored both theoretically and experimentally. The results show that high hyperpolarization levels can be retained using either a (15)N-labeled amide or by applying a magnetic field during transfer of the sample from the polarizer to the MRI scanner.
Sayad, Mohammad; Potthoff, Michael
2015-11-01
The real-time dynamics of a classical spin in an external magnetic field and local exchange coupled to an extended one-dimensional system of non-interacting conduction electrons is studied numerically. Retardation effects in the coupled electron-spin dynamics are shown to be the source for the relaxation of the spin in the magnetic field. Total energy and spin is conserved in the non-adiabatic process. Approaching the new local ground state is therefore accompanied by the emission of dispersive wave packets of excitations carrying energy and spin and propagating through the lattice with Fermi velocity. While the spin dynamics in the regime of strong exchange coupling J is rather complex and governed by an emergent new time scale, the motion of the spin for weak J is regular and qualitatively well described by the Landau-Lifschitz-Gilbert (LLG) equation. Quantitatively, however, the full quantum-classical hybrid dynamics differs from the LLG approach. This is understood as a breakdown of weak-coupling perturbation theory in J in the course of time. Furthermore, it is shown that the concept of the Gilbert damping parameter is ill-defined for the case of a one-dimensional system.
Ren, Jimin; Sherry, A Dean; Malloy, Craig R
2017-04-01
To develop an improved method to measure the (31) P nuclear Overhauser effect (NOE) for evaluation of adenosine triphosphate (ATP) dynamics in terms of correlation time (τc ), and contribution of dipole-dipole (DD) and chemical shift anisotropy (CSA) mechanisms to T1 relaxation of ATP in human brain. The NOE of ATP in human brain was evaluated by monitoring changes in magnetization in the β-ATP signal following a band inversion of all downfield (31) P resonances. The magnetization changes observed were analyzed using the Bloch-McConnell-Solomon formulation to evaluate the relaxation and motion dynamic parameters that describe interactions of ATP with cellular solids in human brain tissue. The maximal transient NOE, observed as a reduction in the β-ATP signal, was 24 ± 2% upon band inversion of γ- and α-ATP, which is 2-3-fold higher than achievable by frequency-selective inversion of either γ- or α-ATP. The rate of (31) P-(31) P cross relaxation (0.21 ± 0.02 s(-1) ) led to a τc value of (9.1 ± 0.8) × 10(-8) s for ATP in human brain. The T1 relaxation of β-ATP is dominated by CSA over the DD mechanism (60%: 40%). The band inversion method proved effective in amplifying (31) P NOE, and thus facilitating ATP τc and relaxation measurements. This technique renders ATP a potentially useful reporter molecule for cellular environments. Magn Reson Med 77:1409-1418, 2017. © 2016 International Society for Magnetic Resonance in Medicine. © 2016 International Society for Magnetic Resonance in Medicine.
Slow dynamics and local quasi-equilibrium-relaxation in supercooled colloidal systems
RubI, J M; SantamarIa-Holek, I; Perez-Madrid, A [Department de Fisica Fonamental, Facultat de Fisica, Universitat de Barcelona, Diagonal 647, 08028 Barcelona (Spain)
2004-06-09
We present a Fokker-Planck description of supercooled colloidal systems exhibiting slow relaxation dynamics. Assuming the existence of a local quasi-equilibrium state during the relaxation of the system, we derive a non-Markovian Fokker-Planck equation for the non-stationary conditional probability. A generalized Stokes-Einstein relation containing the temperature of the system at local quasi-equilibrium instead of the temperature of the bath is obtained. Our results explain experiments showing that the diffusion coefficient is not proportional to the inverse of the effective viscosity at frequencies related to the diffusion timescale.
A preliminary investigation of the dynamic viscoelastic relaxation of bovine cortical bone
Loete T.J.C.
2015-01-01
Full Text Available A new experimental approach is proposed to characterize the dynamic viscoelastic relaxation behaviour of cortical bone. Theoretical models are presented to show that a linear viscoelastic material, when allowed to relax between two long elastic bars, will produce stress, strain and strain rate histories that contain characteristic features. Furthermore, typical experimental results are presented to show that these characteristic features are observed during split Hopkinson bar tests on bovine cortical bone using a Cone-in-Tube striker. The interpretation of this behaviour in the context of a standard linear viscoelastic model is discussed.
Gadolinium oxide nanoplates with high longitudinal relaxivity for magnetic resonance imaging.
Cho, Minjung; Sethi, Richa; Narayanan, Jeyarama Subramanian Ananta; Lee, Seung Soo; Benoit, Denise N; Taheri, Nasim; Decuzzi, Paolo; Colvin, Vicki L
2014-11-21
Molecular-based contrast agents for magnetic resonance imaging (MRI) are often characterized by insufficient relaxivity, thus requiring the systemic injection of high doses to induce sufficient contrast enhancement at the target site. In this work, gadolinium oxide (Gd2O3) nanoplates are produced via a thermal decomposition method. The nanoplates have a core diameter varying from 2 to 22 nm, a thickness of 1 to 2 nm and are coated with either an oleic acid bilayer or an octylamine modified poly(acrylic acid) (PAA-OA) polymer layer. For the smaller nanoplates, longitudinal relaxivities (r1) of 7.96 and 47.2 (mM s)(-1) were measured at 1.41 T for the oleic acid bilayer and PAA-OA coating, respectively. These values moderately reduce as the size of the Gd2O3 nanoplates increases, and are always larger for the PAA-OA coating. Cytotoxicity studies on human dermal fibroblast cells documented no significant toxicity, with 100% cell viability preserved up to 250 μM for the PAA-OA coated Gd2O3 nanoplates. Given the 10 times increase in longitudinal relaxivity over the commercially available Gd-based molecular agents and the favorable toxicity profile, the 2 nm PAA-OA coated Gd2O3 nanoplates could represent a new class of highly effective T1 MRI contrast agents.
Soheilifard, Reza; Makarov, Dmitrii E; Rodin, Gregory J
2011-08-07
Reduced-dimensionality, coarse-grained models are commonly employed to describe the structure and dynamics of large molecular systems. In those models, the dynamics is often described by Langevin equations of motion with phenomenological parameters. This paper presents a rigorous coarse-graining method for the dynamics of linear systems. In this method, as usual, the conformational space of the original atomistic system is divided into master and slave degrees of freedom. Under the assumption that the characteristic timescales of the masters are slower than those of the slaves, the method results in Langevin-type equations of motion governed by an effective potential of mean force. In addition, coarse-graining introduces hydrodynamic-like coupling among the masters as well as non-trivial inertial effects. Application of our method to the long-timescale part of the relaxation spectra of proteins shows that such dynamic coupling is essential for reproducing their relaxation rates and modes.
Dynamic adjustment: an electoral method for relaxed double proportionality
Linusson, Svante
2013-01-01
We describe an electoral system for distributing seats in a parliament. It gives proportionality for the political parties and close to proportionality for constituencies. The system suggested here is a version of the system used in Sweden and other Nordic countries with permanent seats in each constituency and adjustment seats to give proportionality on the national level. In the national election of 2010 the current Swedish system failed to give proportionality between parties. We examine here one possible cure for this unwanted behavior. The main difference compared to the current Swedish system is that the number of adjustment seats is not fixed, but rather dynamically determined to be as low as possible and still insure proportionality between parties.
Harabech, Mariem; Leliaert, Jonathan; Coene, Annelies; Crevecoeur, Guillaume; Van Roost, Dirk; Dupré, Luc
2017-03-01
Magnetic nanoparticle hyperthermia is a cancer treatment in which magnetic nanoparticles (MNPs) are subjected to an alternating magnetic field to induce heat in the tumor. The generated heat of MNPs is characterized by the specific loss power (SLP) due to relaxation phenomena of the MNP. Up to now, several models have been proposed to predict the SLP, one of which is the Linear Response Theory. One parameter in this model is the relaxation time constant. In this contribution, we employ a macrospin model based on the Landau-Lifshitz-Gilbert equation to investigate the relation between the Gilbert damping parameter and the relaxation time constant. This relaxation time has a pre-factor τ0 which is often taken as a fixed value ranging between 10-8 and 10-12 s. However, in reality it has small size dependence. Here, the influence of this size dependence on the calculation of the SLP is demonstrated, consequently improving the accuracy of this estimate.
Generalized Radon--Nikodym Spectral Approach. Application to Power and Energy Relaxation Dynamics
Bobyl, Aleksandr Vasilievich; Kompan, Mikhail Evgenievich; Malyshkin, Vladislav Gennadievich; Novikova, Olga Valentinovna; Terukova, Ekaterina Evgenievna; Agafonov, Dmitry Valentinovich
2016-01-01
Radon--Nikodym approach to relaxation dynamics, where probability density is built first and then used to calculate observable dynamic characteristic is developed. In contrast with $L^2$ norm approaches, such as Fourier or least squares, this new approach does not use a norm, the problem is reduced to finding the spectrum of an operator (virtual Hamiltonian), which is built in a way that eigenvalues represent the dynamic characteristic of interest and eigenvectors represent probability density. The problems of interpolation and obtaining the distribution of relaxation time from timeserie are considered. Application of the theory is demonstrated on a number of model and experimentally measured (Li-Ion degradation, supercapacitors charge/discharge, etc.) timeseries. Software product, implementing the theory is developed.
Levin, P. P.; Kuzmin, V. A.
1990-01-01
The geminate recombination kinetics of the radical pairs produced by quenching of triplet benzophenone or 4-bromobenzophenone by 4-phenylphenol and 4-phenylaniline in aqueous micellar solutions of sodium dodecyl sulfate has been examined using the laser flash technique. Application of an external magnetic field results in the retardation of geminate recombination up to 20 times. The magnetic field dependences are considered in terms of a simple kinetic scheme, which includes the singlet-triplet evolution in the separated states of a pair due to hyperfine coupling and relaxation mechanisms as well as intersystem recombination process due to the spin-orbit coupling in the contact states of a pair.
Dynamic treatment of vibrational energy relaxation in a heterogeneous and fluctuating environment
Fujisaki, Hiroshi
2008-01-01
A computational approach to describe the energy relaxation of a high-frequency vibrational mode in a fluctuating heterogeneous environment is outlined. Extending previous work [H. Fujisaki, Y. Zhang, and J.E. Straub, J. Chem. Phys. {\\bf 124}, 144910 (2006)], second-order time-dependent perturbation theory is employed which includes the fluctuations of the parameters in the Hamiltonian within the vibrational adiabatic approximation. This means that the time-dependent vibrational frequencies along an MD trajectory are obtained via a partial geometry optimization of the solute with fixed solvent and a subsequent normal mode calculation. Adopting the amide I mode of N-methylacetamide in heavy water as a test problem, it is shown that the inclusion of dynamic fluctuations may significantly change the vibrational energy relaxation. In particular, it is found that relaxation occurs in two phases, because for short times ($\\lesssim$ 200 fs) the spectral density appears continuous due to the frequency-time uncertainty...
Relaxation dynamics of aftershocks after large volatility shocks in the SSEC index
Mu, Guo-Hua; Zhou, Wei-Xing
2008-09-01
The relaxation dynamics of aftershocks after large volatility shocks are investigated based on two high-frequency data sets of the Shanghai Stock Exchange Composite (SSEC) index. Compared with previous relevant work, we have defined main financial shocks based on large volatilities rather than large crashes. We find that the occurrence rate of aftershocks with the magnitude exceeding a given threshold for both daily volatility (constructed using 1-minute data) and minutely volatility (using intra-minute data) decays as a power law. The power-law relaxation exponent increases with the volatility threshold and is significantly greater than 1. Taking financial volatility as the counterpart of seismic activity, the power-law relaxation in financial volatility deviates remarkably from the Omori law in Geophysics.
Dielectric study on membrane adsorption and release:Relaxation mechanism and diffusion dynamics
LI YuHong; ZHAO KongShuang; HAN Ying
2008-01-01
Dielectric monitoring of the adsorption or release process of salicylic acid (SA) by chitosan membrane shows that the dielectric spectra of the chitosan membrane/SA solution systems change regularly in the adsorption or release process. By analyzing the regularity, a new mechanism for the relaxations is proposed. The concentration polarization layer (CPL) caused by SA adsorption or release is confirmed to be essential for the dielectric relaxations. The changes of the spectra with time are explained by account of the relationship between CPL properties and dielectric strength. Based on this relaxation mechanism, a theoretical method can be established to calculate dynamical parameters of inner structure of the adsorption or release systems from their dielectric spectra. Therefore, dielectric spec-troscopy is demonstrated to be a promising method for estimating interfacial distribution of ionic sub-stances and their binding to membrane in a non-invasive way.
Dielectric study on membrane adsorption and release: Relaxation mechanism and diffusion dynamics
2008-01-01
Dielectric monitoring of the adsorption or release process of salicylic acid (SA) by chitosan membrane shows that the dielectric spectra of the chitosan membrane/ SA solution systems change regularly in the adsorption or release process. By analyzing the regularity, a new mechanism for the relaxations is proposed. The concentration polarization layer (CPL) caused by SA adsorption or release is confirmed to be essential for the dielectric relaxations. The changes of the spectra with time are explained by account of the relationship between CPL properties and dielectric strength. Based on this relaxation mechanism, a theoretical method can be established to calculate dynamical parameters of inner structure of the adsorption or release systems from their dielectric spectra. Therefore, dielectric spec- troscopy is demonstrated to be a promising method for estimating interfacial distribution of ionic sub- stances and their binding to membrane in a non-invasive way.
Molecular structure-property correlations from optical nonlinearity and thermal-relaxation dynamics.
Bhattacharyya, Indrajit; Priyadarshi, Shekhar; Goswami, Debabrata
2009-02-01
We apply ultrafast single beam Z-scan technique to measure saturation absorption coefficients and nonlinear-refraction coefficients of primary alcohols at 1560 nm. The nonlinear effects result from vibronic transitions and cubic nonlinear-refraction. To measure the pure total third-order nonlinear susceptibility, we removed thermal effects with a frequency optimized optical-chopper. Our measurements of thermal-relaxation dynamics of alcohols, from 1560 nm thermal lens pump and 780 nm probe experiments revealed faster and slower thermal-relaxation timescales, respectively, from conduction and convection. The faster timescale accurately predicts thermal-diffusivity, which decreases linearly with alcohol chain-lengths since thermal-relaxation is slower in heavier molecules. The relation between thermal-diffusivity and alcohol chain-length confirms structure-property relationship.
Li, Linqing; Li, Ningzhi; An, Li; Shen, Jun
2017-09-23
Conventional sequences for metabolite transverse relaxation quantification all generally measure signal changes at different echo times (TEs). However, quantification results obtained via these conventional methods can be very different and are highly dependent on the type of sequence being applied. TE-dependent effects such as diffusion, macromolecule baseline, and J-coupling modulation contribute significantly to these differences. Here, we propose a novel technique-multiple flip angle pulse-driven ratio of longitudinal steady states (MARzss)-for preparing magnetization with T2 /T1 weighting. Using premeasured T1 values, T2 values for metabolites can thereby be determined. The measurement procedure does not require varying TE and is TE independent; T2 , diffusion, and J-coupling effects induced by the readout sequence are cancelled. Longitudinal steady states at different flip angles were prepared with trains of radio frequency pulses interspersed with field gradients. The resulting spatially modulated longitudinal magnetization was acquired with a PRESS readout module. A new linear equation for quantification of MARzss was derived from Bloch equations. By implementing this readout-independent method, T2 measurement of brain metabolites at 7T was demonstrated through Bloch simulations, phantom, and in vivo experiments. The proposed MARzss technique can be used to largely avoid multi-TE associated interference, including diffusion, macromolecules, and J modulation. This MARzss technology, which is uniquely insensitive to readout sequence type and TE, is a promising technique for more accurately probing in vivo metabolite relaxation. Magn Reson Med, 2017. © 2017 International Society for Magnetic Resonance in Medicine. © 2017 International Society for Magnetic Resonance in Medicine.
The short-time intramolecular dynamics of solutes in liquids. II. Vibrational population relaxation
Goodyear, Grant; Stratt, Richard M.
1997-08-01
Events such as the vibrational relaxation of a solute are often well described by writing an effective equation of motion—a generalized Langevin equation—which expresses the surrounding medium's influence on the intramolecular dynamics in terms of a friction and a fluctuating force acting on the solute. These quantities, though, can be obtained from the instantaneous normal modes (INMs) of the system when the relaxation takes place in a fluid, suggesting that we should be able to analyze in some detail the solvent motions driving the relaxation, at least for short times. In this paper we show that this promise can indeed be realized for the specific case of a vibrating diatomic molecule dissolved in an atomic solvent. Despite the relatively long times typical of vibrational population relaxation, it turns out that understanding the behavior of the vibrational friction at the short times appropriate to INMs (a few hundred femtoseconds) often suffices to predict T1 times. We use this observation to probe the dependence of these relaxation rates on thermodynamic conditions and to look at the molecular mechanisms underlying the process. We find that raising the temperature at any given density or raising the density at any given temperature will invariably increase the rate of energy relaxation. However, since these two trends may be in conflict in a typical constant-pressure laboratory experiment, we also find that it is possible to make sense of the "anomalous" inverted temperature dependence recently seen experimentally. We find, as well, that the INM theory—which has no explicit collisions built into it—predicts exactly the same density dependence as the venerable independent-binary-collision (IBC) theory (an intriguing result in view of recent claims that experimental observations of this kind of dependence provide support for the IBC theory). The actual mechanisms behind vibrational population relaxation are revealed by looking in detail at the
Magnetic relaxation measurements of a high-T{sub c} oxide superconductor using microwave absorption
Noujima, Masafumi; Shiiyama, Kenichi; Kinoshita, Chiken [Kyushu Univ., Fukuoka (Japan)
1998-09-01
The pinning potential of Bi{sub 2}Sr{sub 2}CaCu{sub 2}O{sub x} with and without electron irradiation has been determined. Single crystals of Bi{sub 2}Sr{sub 2}CaCu{sub 2}O{sub x} were irradiated with 1 MeV electrons at room temperature in a high voltage electron microscope. Magnetic relaxation of the non-irradiated and irradiated crystals was measured with use of a microwave absorption method at T=79 K and magnetic fields, H = 0 - 0.13 T. The relaxation process was described in terms of the pinning potential and its anisotropy to get the following conclusions. (1) The pinning potential of the irradiated crystal is 2.2 times higher than that of the virgin crystal. (2) Isolated point defects, such as vacancies and interstitials provide good pinning centers. (3) The point defects produced by the electron irradiation make the pinning potential anisotropic. (author)
Lim, Ae Ran; Kim, Sun Ha
2017-05-01
The structural geometry around the 133Cs nuclei in Cs2BBr4 (B = 57Co, 63Cu, and 65Zn) was investigated by examining the chemical shifts and spin-lattice relaxation times in a rotating frame. Two crystallographically inequivalent Cs(1) and Cs(2) sites were differentiated. The spin-lattice relaxation times T1ρ of 133Cs nuclei in three crystals were measured to obtain detailed information about their structural dynamics. Cs(1) surrounded by eleven bromide ions was found to have a longer relaxation time than Cs(2) surrounded by nine bromide ions. The nuclear magnetic resonance (NMR) results were compared to previously reported results for Cs2BCl4. The halogen species in Cs2BX4 (X = Br, Cl) was not found to influence the relaxation time, whereas the B metal ion (B = Co, Cu, and Zn) was found to alter the relaxation time mechanism.
Minecka, Aldona; Kamińska, Ewa; Tarnacka, Magdalena; Dzienia, Andrzej; Madejczyk, Olga; Waliłko, Patrycja; Kasprzycka, Anna; Kamiński, Kamil; Paluch, Marian
2017-08-01
In this paper, broadband dielectric spectroscopy was applied to investigate molecular dynamics of 1,2,3,4,6-penta-O-(trimethylsilyl)-D-glucopyranose (S-GLU) at ambient and elevated pressures. Our studies showed that apart from the structural relaxation, one well resolved asymmetric secondary process (initially labeled as β) is observed in the spectra measured at p = 0.1 MPa. Analysis with the use of the coupling model and criterion proposed by Ngai and Capaccioli indicated that the β-process in S-GLU is probably a Johari-Goldstein relaxation of intermolecular origin. Further high pressure experiments demonstrated that there are in fact two secondary processes contributing to the β-relaxation. Therefore, one can postulate that the coupling model is a necessary, but not sufficient criterion to identify the true nature of the given secondary relaxation process. The role of pressure experiments in better understanding of the molecular origin of local mobility seems to be much more important. Interestingly, our research also revealed that the structural relaxation in S-GLU is very sensitive to compression. It was reflected in an extremely high pressure coefficient of the glass transition temperature (dTg/dp = 412 K/GPa). According to the literature data, such a high value of dTg/dp has not been obtained so far for any H-bonded, van der Waals, or polymeric glass-formers.
Allnér, Olof; Foloppe, Nicolas; Nilsson, Lennart
2015-01-22
Molecular dynamics simulations of E. coli glutaredoxin1 in water have been performed to relate the dynamical parameters and entropy obtained in NMR relaxation experiments, with results extracted from simulated trajectory data. NMR relaxation is the most widely used experimental method to obtain data on dynamics of proteins, but it is limited to relatively short timescales and to motions of backbone amides or in some cases (13)C-H vectors. By relating the experimental data to the all-atom picture obtained in molecular dynamics simulations, valuable insights on the interpretation of the experiment can be gained. We have estimated the internal dynamics and their timescales by calculating the generalized order parameters (O) for different time windows. We then calculate the quasiharmonic entropy (S) and compare it to the entropy calculated from the NMR-derived generalized order parameter of the amide vectors. Special emphasis is put on characterizing dynamics that are not expressed through the motions of the amide group. The NMR and MD methods suffer from complementary limitations, with NMR being restricted to local vectors and dynamics on a timescale determined by the rotational diffusion of the solute, while in simulations, it may be difficult to obtain sufficient sampling to ensure convergence of the results. We also evaluate the amount of sampling obtained with molecular dynamics simulations and how it is affected by the length of individual simulations, by clustering of the sampled conformations. We find that two structural turns act as hinges, allowing the α helix between them to undergo large, long timescale motions that cannot be detected in the time window of the NMR dipolar relaxation experiments. We also show that the entropy obtained from the amide vector does not account for correlated motions of adjacent residues. Finally, we show that the sampling in a total of 100 ns molecular dynamics simulation can be increased by around 50%, by dividing the
Fractional dynamics of charged particles in magnetic fields
Coronel-Escamilla, A.; Gómez-Aguilar, J. F.; Alvarado-Méndez, E.; Guerrero-Ramírez, G. V.; Escobar-Jiménez, R. F.
2016-02-01
In many physical applications the electrons play a relevant role. For example, when a beam of electrons accelerated to relativistic velocities is used as an active medium to generate Free Electron Lasers (FEL), the electrons are bound to atoms, but move freely in a magnetic field. The relaxation time, longitudinal effects and transverse variations of the optical field are parameters that play an important role in the efficiency of this laser. The electron dynamics in a magnetic field is a means of radiation source for coupling to the electric field. The transverse motion of the electrons leads to either gain or loss energy from or to the field, depending on the position of the particle regarding the phase of the external radiation field. Due to the importance to know with great certainty the displacement of charged particles in a magnetic field, in this work we study the fractional dynamics of charged particles in magnetic fields. Newton’s second law is considered and the order of the fractional differential equation is (0;1]. Based on the Grünwald-Letnikov (GL) definition, the discretization of fractional differential equations is reported to get numerical simulations. Comparison between the numerical solutions obtained on Euler’s numerical method for the classical case and the GL definition in the fractional approach proves the good performance of the numerical scheme applied. Three application examples are shown: constant magnetic field, ramp magnetic field and harmonic magnetic field. In the first example the results obtained show bistability. Dissipative effects are observed in the system and the standard dynamic is recovered when the order of the fractional derivative is 1.
Surface magnetic domains dynamic in machined steel
Blažek D.
2014-07-01
Full Text Available This contribution deals with an observation of the magnetic dynamic of different types of the machined surface of bearing steel. The Bakhausen noise (BN measurements are presented here as commonly introduced in industry for quality control due to the extremely sensitivity of the magnetic domains wall dynamics to the microstructure of material. The results of magneto-optical measurements are presented with the goal to explain the observed BN anisotropy. It is shown that BN anisotropy is associated with uniaxal magnetic anisotropy introduced by hard milling which causes the principally different magnetic reversals processes in orthogonal directions.
Escanyé, J. M.; Canet, D.; Robert, J.
Water proton longitudinal relaxation has been investigated in frozen mouse tissues including tumors. The nonfreezable water which gives rise to a relatively sharp NMR signal at this temperature (263 K) is identified as water bound to macromolecules. Measurements have been carried out by the nonselective inversion-recovery method at 90 and 6 MHz. Partially selective inversion has been achieved at 90 MHz by the DANTE sequence. The experimental data are analyzed by means of Solomon-type equations. This analysis provides the cross-relaxation term from which the dipolar contribution to water relaxation rate, arising from interactions with macromolecular protons, is calculated. This contribution seems to be dominant. The number of water protons interacting with a given macromolecular proton is found to be of the order of 10. The data at both frequencies can be consistently interpreted in terms of water diffusion, with a characteristic time of about 10 -9 sec. These conclusions are valid for all the tissues investigated here, their relaxation parameters exhibiting only slight differences.
Nuclear magnetic relaxation study of poly(ethylene oxide)-lithium salt based electrolytes
Donoso, J. P.; Bonagamba, T. J.; Panepucci, H. C.; Oliveira, L. N.; Gorecki, W.; Berthier, C.; Armand, M.
1993-06-01
We have studied the low-temperature NMR line shape for three nuclei (1H, 7Li, and 19F) in poly(ethylene oxide)-lithium salts (LiClO4, LiBF4, and LiAsF6) solid polymer ionic conductors and measured their spin-lattice relaxation rates as functions of frequency and temperature. The three nuclei probe the dynamics of the polymer segments, the cations, and the anions. We find that the Li+ cations follow the segmental motion of the chain, while the anions move independently. Homonuclear interactions and heteronuclear interactions with the polymer and the anion contribute to the 7Li line shape. When the heteronuclear contributions were selectively eliminated by the decoupling method, it was found that the Li-H interaction accounts for 80%-90% of the linewidth. Additional evidence for the correlation between the cationic and the polymeric motions is provided by the remarkably similar temperature dependences of the measured relaxation rates for 7Li and 1H, which differ significantly from the dependence for 19F. The frequency dependence of the relaxation rates is poorly described by the Bloembergen, Purcell, and Pound model; a recently developed graphical procedure nevertheless shows that the motion of the protons and the anions is governed by a single time scale, while the 7Li ions are affected by an additional scale, associated with the coupling of its quadrupolar moment to the electric-field gradient.
Wiedenmann, A.; Keiderling, U.; Meissner, M.; Wallacher, D.; Gähler, R.; May, R.P.; Prévost, S.; Klokkenburg, M.; Erne, B.H.; Kohlbrecher, J.
2008-01-01
The dynamics of ordering and relaxation processes in magnetic colloids has been studied by means of stroboscopic small angle neutron scattering techniques in an oscillating magnetic field. Surfactant stabilized ferrofluids (FFs) of Fe3O4 and Co nanoparticles have been investigated as a function of t
Carrier relaxation in (In,Ga)As quantum dots with magnetic field-induced anharmonic level structure
Kurtze, H.; Bayer, M. [Experimentelle Physik 2, TU Dortmund, D-44221 Dortmund (Germany)
2016-07-04
Sophisticated models have been worked out to explain the fast relaxation of carriers into quantum dot ground states after non-resonant excitation, overcoming the originally proposed phonon bottleneck. We apply a magnetic field along the quantum dot heterostructure growth direction to transform the confined level structure, which can be approximated by a Fock–Darwin spectrum, from a nearly equidistant level spacing at zero field to strong anharmonicity in finite fields. This changeover leaves the ground state carrier population rise time unchanged suggesting that fast relaxation is maintained upon considerable changes of the level spacing. This corroborates recent models explaining the relaxation by polaron formation in combination with quantum kinetic effects.
Jahur A Mondal; Sandeep Verma; Hirendra N Ghosh; Dipak K Palit
2008-01-01
Relaxation dynamics of the excited singlet states of 2,5-bis-(N-methyl-N-1,3-propdienylaniline)-cyclopentanone (MPAC), a ketocyanine dye, have been investigated using steady-state absorption and emission as well as femtosecond time-resolved absorption spectroscopic techniques. Following photoexcitation using 400 nm light, the molecule is excited to the S2 state, which is fluorescent in rigid matrices at 77 K. S2 state is nearly non-fluorescent in solution and has a very short lifetime (0.5 ± 0.2 ps). In polar aprotic solvents, the S1 state follows a complex multi-exponential relaxation dynamics consisting of torsional motion of the donor groups, solvent re-organization as well as photoisomerization processes. However, in alcoholic solvents, solvent re-organization via intermolecular hydrogen-bonding interaction is the only relaxation process observed in the S1 state. In trifluoroethanol, a strong hydrogen bonding solvent, conversion of the non-hydrogen-bonded form, which is formed following photoexcitation, to the hydrogen-bonded complex has been clearly evident in the relaxation process of the S1 state.
The Role of Rydberg-Valence Coupling in the Ultrafast Relaxation Dynamics of Acetone.
Koch, Markus; Thaler, Bernhard; Heim, Pascal; Ernst, Wolfgang E
2017-08-31
The electronic structure of excited states of acetone is represented by a Rydberg manifold that is coupled to valence states which provide very fast and efficient relaxation pathways. We observe and characterize the transfer of population from photoexcited Rydberg states (6p, 6d, 7s) to a whole series of lower Rydberg states (3p to 4d) and a simultaneous decay of population from these states. We obtain these results with time-resolved photoelectron-photoion coincidence (PEPICO) detection in combination with the application of Bayesian statistics for data analysis. Despite the expectedly complex relaxation behavior, we find that a simple sequential decay model is able to describe the observed PEPICO transients satisfactorily. We obtain a slower decay (∼320 fs) from photoexcited states compared to a faster decay (∼100 fs) of states that are populated by internal conversion, demonstrating that different relaxation dynamics are active. Within the series of Rydberg states populated by internal conversion, the decay dynamics seem to be similar, and a trend of slower decay from lower states indicates an increasingly higher energy barrier along the decay pathway for lower states. The presented results agree all in all with previous relaxation studies within the Rydberg manifold. The state-resolved observation of transient population ranging from 3p to 4d can serve as reference for time-dependent simulations.
Relaxation dynamics of a compressible bilayer vesicle containing highly viscous fluid.
Sachin Krishnan, T V; Okamoto, Ryuichi; Komura, Shigeyuki
2016-12-01
We study the relaxation dynamics of a compressible bilayer vesicle with an asymmetry in the viscosity of the inner and outer fluid medium. First we explore the stability of the vesicle free energy which includes a coupling between the membrane curvature and the local density difference between the two monolayers. Two types of instabilities are identified: a small wavelength instability and a larger wavelength instability. Considering the bulk fluid viscosity and the inter-monolayer friction as the dissipation sources, we next employ Onsager's variational principle to derive the coupled equations both for the membrane and the bulk fluid. The three relaxation modes are coupled to each other due to the bilayer and the spherical structure of the vesicle. Most importantly, a higher fluid viscosity inside the vesicle shifts the crossover mode between the bending and the slipping to a larger value. As the vesicle parameters approach the unstable regions, the relaxation dynamics is dramatically slowed down, and the corresponding mode structure changes significantly. In some limiting cases, our general result reduces to the previously obtained relaxation rates.
Relaxation dynamics of a compressible bilayer vesicle containing highly viscous fluid
Sachin Krishnan, T. V.; Okamoto, Ryuichi; Komura, Shigeyuki
2016-12-01
We study the relaxation dynamics of a compressible bilayer vesicle with an asymmetry in the viscosity of the inner and outer fluid medium. First we explore the stability of the vesicle free energy which includes a coupling between the membrane curvature and the local density difference between the two monolayers. Two types of instabilities are identified: a small wavelength instability and a larger wavelength instability. Considering the bulk fluid viscosity and the inter-monolayer friction as the dissipation sources, we next employ Onsager's variational principle to derive the coupled equations both for the membrane and the bulk fluid. The three relaxation modes are coupled to each other due to the bilayer and the spherical structure of the vesicle. Most importantly, a higher fluid viscosity inside the vesicle shifts the crossover mode between the bending and the slipping to a larger value. As the vesicle parameters approach the unstable regions, the relaxation dynamics is dramatically slowed down, and the corresponding mode structure changes significantly. In some limiting cases, our general result reduces to the previously obtained relaxation rates.
Borlaug, Barry A; Jaber, Wissam A; Ommen, Steve R; Lam, Carolyn S P; Redfield, Margaret M; Nishimura, Rick A
2011-06-01
Recent studies have examined haemodynamic changes with stressors such as isometric handgrip and rapid atrial pacing in heart failure with preserved ejection fraction (HFpEF), but little is known regarding left ventricular (LV) pressure-volume responses during dynamic exercise. To assess LV haemodynamic responses to dynamic exercise in patients with HFpEF. Twenty subjects with normal ejection fraction (EF) and exertional dyspnoea underwent invasive haemodynamic assessment during dynamic exercise to evaluate suspected HFpEF. LV end-diastolic pressure was elevated at rest (>15 mm Hg, n=18) and with exercise (≥20 mm Hg, n=20) in all subjects, consistent with HFpEF. Heart rate (HR), blood pressure, arterial elastance and cardiac output increased with exercise (all pincreased by 43-56% with exercise (both pincreases in HR and the proportion of diastole that elapsed prior to estimated complete relaxation increased (pincreased 50% during exercise (p=0.0003). Exercise increases in LV filling pressures correlated with changes in diastolic relaxation rates, chamber stiffness and arterial afterload but were not related to alterations in preload volume, HR or cardiac output. In patients with newly diagnosed HFpEF, LV filling pressures increase during dynamic exercise in association with inadequate enhancement of relaxation and acute increases in LV chamber stiffness. Therapies that enhance diastolic reserve function may improve symptoms of exertional intolerance in patients with hypertensive heart disease and early HFpEF.
Pulsed field probe of real time magnetization dynamics in magnetic nanoparticle systems
Foulkes, T.; Syed, M.; Taplin, T.
2015-05-01
Magnetic nanoparticles (MNPs) are extensively used in biotechnology. These applications rely on magnetic properties that are a keen function of MNP size, distribution, and shape. Various magneto-optical techniques, including Faraday Rotation (FR), Cotton-Mouton Effect, etc., have been employed to characterize magnetic properties of MNPs. Generally, these measurements employ AC or DC fields. In this work, we describe the results from a FR setup that uses pulsed magnetic fields and an analysis technique that makes use of the entire pulse shape to investigate size distribution and shape anisotropy. The setup employs a light source, polarizing components, and a detector that are used to measure the rotation of light from a sample that is subjected to a pulsed magnetic field. This magnetic field "snapshot" is recorded alongside the intensity pulse of the sample's response. This side by side comparison yields useful information about the real time magnetization dynamics of the system being probed. The setup is highly flexible with variable control of pulse length and peak magnitude. Examining the raw data for the response of bare Fe3O4 and hybrid Au and Fe3O4 nanorods reveals interesting information about Brownian relaxation and the hydrodynamic size of these nanorods. This analysis exploits the self-referencing nature of this measurement to highlight the impact of an applied field on creating a field induced transparency for a longitudinal measurement. Possible sources for this behavior include shape anisotropy and field assisted aggregate formation.
Le Roy, Jennifer J; Korobkov, Ilia; Kim, Jee Eon; Schelter, Eric J; Murugesu, Muralee
2014-02-21
Magnet-like behaviour, in the form of slow relaxation of the magnetization, was observed for a monometallic cerium(III) sandwich complex. The use of trimethylsilyl substituted COT ligands (COT'') led to the formation of a staggered COT'' arrangement in the cerocene-type sandwich complex with a well-defined oxidation state of +3 for the Ce ion.
Undulator with dynamic compensation of magnetic forces
Gluskin, Efim; Trakhtenberg, Emil; Xu, Joseph Z.
2016-05-31
A method and apparatus for implementing dynamic compensation of magnetic forces for undulators are provided. An undulator includes a respective set of magnet arrays, each attached to a strongback, and placed on horizontal slides and positioned parallel relative to each other with a predetermined gap. Magnetic forces are compensated by a set of compensation springs placed along the strongback. The compensation springs are conical springs having exponential-force characteristics that substantially match undulator magnetic forces independently of the predetermined gap. The conical springs are positioned along the length of the magnets.
Undulator with dynamic compensation of magnetic forces
Gluskin, Efim; Trakhtenberg, Emil; Xu, Joseph Z.
2016-05-31
A method and apparatus for implementing dynamic compensation of magnetic forces for undulators are provided. An undulator includes a respective set of magnet arrays, each attached to a strongback, and placed on horizontal slides and positioned parallel relative to each other with a predetermined gap. Magnetic forces are compensated by a set of compensation springs placed along the strongback. The compensation springs are conical springs having exponential-force characteristics that substantially match undulator magnetic forces independently of the predetermined gap. The conical springs are positioned along the length of the magnets.
SPILADY: A parallel CPU and GPU code for spin-lattice magnetic molecular dynamics simulations
Ma, Pui-Wai; Dudarev, S. L.; Woo, C. H.
2016-10-01
Spin-lattice dynamics generalizes molecular dynamics to magnetic materials, where dynamic variables describing an evolving atomic system include not only coordinates and velocities of atoms but also directions and magnitudes of atomic magnetic moments (spins). Spin-lattice dynamics simulates the collective time evolution of spins and atoms, taking into account the effect of non-collinear magnetism on interatomic forces. Applications of the method include atomistic models for defects, dislocations and surfaces in magnetic materials, thermally activated diffusion of defects, magnetic phase transitions, and various magnetic and lattice relaxation phenomena. Spin-lattice dynamics retains all the capabilities of molecular dynamics, adding to them the treatment of non-collinear magnetic degrees of freedom. The spin-lattice dynamics time integration algorithm uses symplectic Suzuki-Trotter decomposition of atomic coordinate, velocity and spin evolution operators, and delivers highly accurate numerical solutions of dynamic evolution equations over extended intervals of time. The code is parallelized in coordinate and spin spaces, and is written in OpenMP C/C++ for CPU and in CUDA C/C++ for Nvidia GPU implementations. Temperatures of atoms and spins are controlled by Langevin thermostats. Conduction electrons are treated by coupling the discrete spin-lattice dynamics equations for atoms and spins to the heat transfer equation for the electrons. Worked examples include simulations of thermalization of ferromagnetic bcc iron, the dynamics of laser pulse demagnetization, and collision cascades.
Relaxation dynamics and exciton energy transfer in the low-temperature phase of MEH-PPV
Consani, Cristina; Koch, Federico [Institut für Physikalische und Theoretische Chemie, Universität Würzburg, Am Hubland, 97074 Würzburg (Germany); Panzer, Fabian; Unger, Thomas; Köhler, Anna [Lehrstuhl Experimentalphysik II, Universität Bayreuth, Universitätsstraße 30, 95440 Bayreuth (Germany); Brixner, Tobias, E-mail: brixner@phys-chemie.uni-wuerzburg.de [Institut für Physikalische und Theoretische Chemie, Universität Würzburg, Am Hubland, 97074 Würzburg (Germany); Center for Nanosystems Chemistry (CNC), Universität Würzburg, Am Hubland, 97074 Würzburg (Germany)
2015-06-07
Understanding the effects of aggregation on exciton relaxation and energy transfer is relevant to control photoinduced function in organic electronics and photovoltaics. Here, we explore the photoinduced dynamics in the low-temperature aggregated phase of a conjugated polymer by transient absorption and coherent electronic two-dimensional (2D) spectroscopy. Coherent 2D spectroscopy allows observing couplings among photoexcited states and discriminating band shifts from homogeneous broadening, additionally accessing the ultrafast dynamics at various excitation energies simultaneously with high spectral resolution. By combining the results of the two techniques, we differentiate between an initial exciton relaxation, which is not characterized by significant exciton mobility, and energy transport between different chromophores in the aggregate.
The spin-temperature theory of dynamic nuclear polarization and nuclear spin-lattice relaxation
Byvik, C. E.; Wollan, D. S.
1974-01-01
A detailed derivation of the equations governing dynamic nuclear polarization (DNP) and nuclear spin lattice relaxation by use of the spin temperature theory has been carried to second order in a perturbation expansion of the density matrix. Nuclear spin diffusion in the rapid diffusion limit and the effects of the coupling of the electron dipole-dipole reservoir (EDDR) with the nuclear spins are incorporated. The complete expression for the dynamic nuclear polarization has been derived and then examined in detail for the limit of well resolved solid effect transitions. Exactly at the solid effect transition peaks, the conventional solid-effect DNP results are obtained, but with EDDR effects on the nuclear relaxation and DNP leakage factor included. Explicit EDDR contributions to DNP are discussed, and a new DNP effect is predicted.
Dynamics of disordered and frustrated magnets
Woo, Na Yoon
Gd3Ga5O12 (GGG) is an insulating Heisenberg antiferromagnet. It is highly frustrated owing to its garnet structure, which is composed of elementary triangles with dominant antiferromagnetic interactions. We studied the effect of disorder in this geometrically frustrated system by changing the level of disorder in GGG:Ndx with x ranging from 0 to 1%. We measured the AC magnetic susceptibility in both the linear and nonlinear regimes and characterized the low temperature phases. As a result, we observed signatures of short range order in the 0% and 0.1% crystals, but not in the 1% sample, indicating that the order is suppressed in the 1% sample because of increasing frustration. The Nd doping compensates for the Gd-Ga off stoichiometry and pushes the system to a more perfectly frustrated state. We used the non-linear response to characterize the evolution of isolated spin clusters as a function of x. The Nd doping effectively relieves the net disorder. Hence the sample with the highest doping presents the smallest net correlated moments and the smallest onset field to activate the clusters from the background spin bath. The second project we report addresses the nonequilibrium dynamics of two related spin glasses. The model systems are the Ising magnets LiHo xY1--xF4 with x = 0.167 and 0.198. Although both systems undergo spin glass transitions, the mechanism that drives the phase transition is known to be different. The diluted sample is more affected by entanglement and in the concentrated system, the random field plays a more important role. In this thesis, we performed preliminary thermal and quantum aging experiments to compare the two systems. In the classical aging measurement, with temperature as the pertinent variable, the decay is exponential and measures primarily the response of the lattice. However quantum aging measurements using transverse field probe the spin relaxation character. The x = 0.167 and 0.198 crystals decay in opposite directions
Magnetization dynamics down to a zero field in dilute (Cd,Mn)Te quantum wells.
Goryca, M; Ferrand, D; Kossacki, P; Nawrocki, M; Pacuski, W; Maślana, W; Gaj, J A; Tatarenko, S; Cibert, J; Wojtowicz, T; Karczewski, G
2009-01-30
The evolution of the magnetization in (Cd,Mn)Te quantum wells after a short pulse of magnetic field was determined from the giant Zeeman shift of spectroscopic lines. The dynamics in the absence of a static magnetic field was found to be up to 3 orders of magnitude faster than that at 1 T. Hyperfine interaction and strain are mainly responsible for the fast decay. The influence of a hole gas is clearly visible: at zero field anisotropic holes stabilize the system of Mn ions, while in a magnetic field of 1 T they are known to speed up the decay by opening an additional relaxation channel.
Low Parametric Sensitivity Realizations with relaxed L2-dynamic-range-scaling constraints
Hilaire, Thibault
2009-01-01
This paper presents a new dynamic-range scaling for the implementation of filters/controllers in state-space form. Relaxing the classical L2-scaling constraints by specific fixed-point considerations allows for a higher degree of freedom for the optimal L2-parametric sensitivity problem. However, overflows in the implementation are still prevented. The underlying constrained problem is converted into an unconstrained problem for which a solution can be provided. This leads to realizations whi...
Improved dynamical scaling analysis using the kernel method for nonequilibrium relaxation.
Echinaka, Yuki; Ozeki, Yukiyasu
2016-10-01
The dynamical scaling analysis for the Kosterlitz-Thouless transition in the nonequilibrium relaxation method is improved by the use of Bayesian statistics and the kernel method. This allows data to be fitted to a scaling function without using any parametric model function, which makes the results more reliable and reproducible and enables automatic and faster parameter estimation. Applying this method, the bootstrap method is introduced and a numerical discrimination for the transition type is proposed.
Low Parametric Sensitivity Realizations with relaxed L2-dynamic-range-scaling constraints
Hilaire, Thibault
2009-01-01
This paper presents a new dynamic-range scaling for the implementation of filters/controllers in state-space form. Relaxing the classical L2-scaling constraints by specific fixed-point considerations allows for a higher degree of freedom for the optimal L2-parametric sensitivity problem. However, overflows in the implementation are still prevented. The underlying constrained problem is converted into an unconstrained problem for which a solution can be provided. This leads to realizations whi...
Gadolinium oxide nanoplates with high longitudinal relaxivity for magnetic resonance imaging
Cho, Minjung; Sethi, Richa; Ananta Narayanan, Jeyarama Subramanian; Lee, Seung Soo; Benoit, Denise N.; Taheri, Nasim; Decuzzi, Paolo; Colvin, Vicki L.
2014-10-01
Molecular-based contrast agents for magnetic resonance imaging (MRI) are often characterized by insufficient relaxivity, thus requiring the systemic injection of high doses to induce sufficient contrast enhancement at the target site. In this work, gadolinium oxide (Gd2O3) nanoplates are produced via a thermal decomposition method. The nanoplates have a core diameter varying from 2 to 22 nm, a thickness of 1 to 2 nm and are coated with either an oleic acid bilayer or an octylamine modified poly(acrylic acid) (PAA-OA) polymer layer. For the smaller nanoplates, longitudinal relaxivities (r1) of 7.96 and 47.2 (mM s)-1 were measured at 1.41 T for the oleic acid bilayer and PAA-OA coating, respectively. These values moderately reduce as the size of the Gd2O3 nanoplates increases, and are always larger for the PAA-OA coating. Cytotoxicity studies on human dermal fibroblast cells documented no significant toxicity, with 100% cell viability preserved up to 250 μM for the PAA-OA coated Gd2O3 nanoplates. Given the 10 times increase in longitudinal relaxivity over the commercially available Gd-based molecular agents and the favorable toxicity profile, the 2 nm PAA-OA coated Gd2O3 nanoplates could represent a new class of highly effective T1 MRI contrast agents.Molecular-based contrast agents for magnetic resonance imaging (MRI) are often characterized by insufficient relaxivity, thus requiring the systemic injection of high doses to induce sufficient contrast enhancement at the target site. In this work, gadolinium oxide (Gd2O3) nanoplates are produced via a thermal decomposition method. The nanoplates have a core diameter varying from 2 to 22 nm, a thickness of 1 to 2 nm and are coated with either an oleic acid bilayer or an octylamine modified poly(acrylic acid) (PAA-OA) polymer layer. For the smaller nanoplates, longitudinal relaxivities (r1) of 7.96 and 47.2 (mM s)-1 were measured at 1.41 T for the oleic acid bilayer and PAA-OA coating, respectively. These values
Turton, David A; Sonnleitner, Thomas; Ortner, Alex; Walther, Markus; Hefter, Glenn; Seddon, Kenneth R; Stana, Simona; Plechkova, Natalia V; Buchner, Richard; Wynne, Klaas
2012-01-01
The structure and dynamics of ionic liquids (ILs) are unusual due to the strong interactions between the ions and counter ions. These microscopic properties determine the bulk transport properties critical to applications of ILs such as advanced fuel cells. The terahertz dynamics and slower relaxations of simple alkylammonium nitrate protic ionic liquids (PILs) are here studied using femtosecond optical Kerr-effect spectroscopy, dielectric relaxation spectroscopy, and terahertz time-domain spectroscopy. The observed dynamics give insight into more general liquid behaviour while comparison with glass-forming liquids reveals an underlying power-law decay and relaxation rates suggest supramolecular structure and nanoscale segregation.
Dynamics of Solid Body in Magnetic Suspension under Periodic Excitation
A. M. Gouskov
2017-01-01
Full Text Available The article studies dynamics of ferromagnetic body in hybrid magnetic suspension (HMS. The body is supposed to have one degree of freedom and a nonlinear magnetic force dependence on the current and displacement. The magnetic force induced in the HMS is divided into a passive component and an active one. Specifying the law of current variation in the coil allows us to generate nonlinear oscillations under electromagnet action. To provide periodic excitation the appropriate law of the current variation in the electromagnet coil is proposed. The mathematical model includes external periodic step-excitation. The equation of motion is formed. The scales of similarity are highlighted in the system, and the equation of motion is reduced to dimensionless form.The motion dynamics is studied numerically. The relaxation method was used to determine the periodic motions at different values of dimensionless frequency of the electromagnet excitation as well as to estimate the influence of other dimensionless parameters on the system dynamics. The amplitude-frequency curve analysis allows us to come to conclusion that the nature of system nonlinearity is rigid. Adding the external periodic step-excitation leads to the qualitative change in the nature of movement. This points to the occurrence of bifurcation.
Yamamoto, S.
2000-11-01
In response to recent nuclear magnetic resonance measurements on a ferrimagnetic chain compound NiCu(C 7H 6N 2O 6)(H 2O) 3·2H 2O [Solid State Commun. 113 (2000) 433], we calculate the nuclear spin-lattice relaxation rate 1/ T1 in terms of a modified spin-wave theory. Emphasizing that the dominant relaxation mechanism arises from the direct (single-magnon) process rather than the Raman (two-magnon) one, we explain the observed temperature and applied-field dependences of 1/ T1. Ferrimagnetic relaxation phenomena are generally discussed and novel ferrimagnets with extremely slow dynamics are predicted.
Tacke, Christian
2015-07-01
Multi spin systems with spin 1/2 nuclei and dipolar coupled quadrupolar nuclei can show so called ''quadrupolar dips''. There are two main reasons for this behavior: polarization transfer and relaxation. They look quite alike and without additional research cannot be differentiated easily in most cases. These two phenomena have quite different physical and theoretical backgrounds. For no or very slow dynamics, polarization transfer will take place, which is energy conserving inside the spin system. This effect can entirely be described using quantum mechanics on the spin system. Detailed knowledge about the crystallography is needed, because this affects the relevant hamiltonians directly. For systems with fast enough dynamics, relaxation takes over, and the energy flows from the spin system to the lattice; thus a more complex theoretical description is needed. This description has to include a dynamic model, usually in the form of a spectral density function. Both models should include detailed modelling of the complete spin system. A software library was developed to be able to model complex spin systems. It allows to simulate polarization transfer or relaxation effects. NMR measurements were performed on the protonic conductor K{sub 3}H(SO{sub 4}){sub 2}. A single crystal shows sharp quadrupolar dips at room temperature. Dynamics could be excluded using relaxation measurements and literature values. Thus, a polarization transfer analysis was used to describe those dips with good agreement. As a second system, imidazolium based molecular crystals were analyzed. The quadrupolar dips were expected to be caused by polarization transfer; this was carefully analyzed and found not to be true. A relaxation based analysis shows good agreement with the measured data in the high temperature area. It leverages a two step spectral density function, which indicates two distinct dynamic processes happening in this system.
Magnetocaloric effect in Mn2-pyrazole-[Nb(CN)8] molecular magnet by relaxation calorimetry
Pełka, R.; Gajewski, M.; Miyazaki, Y.; Yamashita, S.; Nakazawa, Y.; Fitta, M.; Pinkowicz, D.; Sieklucka, B.
2016-12-01
Magnetocaloric effect in {[Mn(pyrazole)4]2[Nb(CN)8]·4 H2O}n molecular magnet is reported. It crystallizes in tetragonal I41/a space group. The compound exhibits a phase transition to a long range magnetically ordered state at TN ≈ 22.8 K. Temperature dependences of the magnetic entropy change ΔSM as well as the adiabatic temperature change ΔTad due to applied field change μ0 ΔH in the range of 0.1-9 T have been inferred from the relaxation calorimetry measurements. A systematic approximate approach has been used to determine the lattice contribution to the heat capacity. The maximum value of ΔSM for μ0 ΔH = 5 T is 6.83 J mol-1 K-1 (6.65 J kg-1 K-1) at 24.3 K. The corresponding maximum value of ΔTad is 1.4 K at 23.8 K. The temperature dependence of the exponent n characterizing the field dependence of ΔSM has been estimated. It attains the value of 0.64 at the transition temperature, which is consistent with the 3D Heisenberg universality class. A hitherto unobserved two-peak structure has been revealed in the temperature dependence of ΔTad.
Eugene, M.; Lechat, P.; Hadjiisky, P.; Teillac, A.; Grosgogeat, Y.; Cabrol, C.
1986-01-01
It should be possible to detect heart transplant rejection by nuclear magnetic resonance (NMR) imaging if it induces myocardial T1 and T2 proton relaxation time alterations or both. We studied 20 Lewis rats after a heterotopic heart transplantation. In vitro measurement of T1 and T2 was performed on a Minispec PC20 (Bruker) 3 to 9 days after transplantation. Histologic analysis allowed the quantification of rejection process based on cellular infiltration and myocardiolysis. Water content, a major determinant of relaxation time, was also studied. T1 and T2 were significantly prolonged in heterotopic vs orthotopic hearts (638 +/- 41 msec vs 606 +/- 22 msec for T1, p less than 0.01 and 58.2 +/- 8.4 msec vs 47.4 +/- 1.9 msec for T2, p less than 0.001). Water content was also increased in heterotopic hearts (76.4 +/- 2.3 vs 73.8 +/- 1.0, p less than 0.01). Most importantly, we found close correlations between T1 and especially T2 vs water content, cellular infiltration, and myocardiolysis. We conclude that rejection reaction should be noninvasively detected by NMR imaging, particularly with pulse sequences emphasizing T2.
Nuclear magnetic resonance relaxation times for human lung cancer and lung tissues
Matsuura, Yoshifumi; Shioya, Sumie; Kurita, Daisaku; Ohta, Takashi; Haida, Munetaka; Ohta, Yasuyo [Tokai Univ., Isehara, Kanagawa (Japan). School of Medicine; Suda, Syuichi; Fukuzaki, Minoru
1994-12-01
We investigated the nuclear magnetic resonance (NMR) relaxation times, T{sub 1} and T{sub 2}, for lung cancer tissue, and other samples of lung tissue obtained from surgical specimens. The samples were nine squamous cell carcinomas, five necrotic squamous cell carcinomas, 15 adenocarcinomas, two benign mesotheliomas, and 13 fibrotic lungs. The relaxation times were measured with a 90 MHz NMR spectrometer and the results were correlated with histological changes. The values of T{sub 1} and T{sub 2} for squamous cell carcinoma and mesothelioma were significantly longer than those of adenocarcinoma and fibrotic lung tissue. There were no significant differences in values of T{sub 1} and T{sub 2} between adenocarcinoma and lung tissue. The values of T{sub 1} and T{sub 2} for benign mesothelioma were similar to those of squamous cell carcinoma, which suggested that increases in T{sub 1} and T{sub 2} are not specific to malignant tissues. (author).
Magnetic-field sensing with quantum error detection under the effect of energy relaxation
Matsuzaki, Yuichiro; Benjamin, Simon
2017-03-01
A solid state spin is an attractive system with which to realize an ultrasensitive magnetic field sensor. A spin superposition state will acquire a phase induced by the target field, and we can estimate the field strength from this phase. Recent studies have aimed at improving sensitivity through the use of quantum error correction (QEC) to detect and correct any bit-flip errors that may occur during the sensing period. Here we investigate the performance of a two-qubit sensor employing QEC and under the effect of energy relaxation. Surprisingly, we find that the standard QEC technique to detect and recover from an error does not improve the sensitivity compared with the single-qubit sensors. This is a consequence of the fact that the energy relaxation induces both a phase-flip and a bit-flip noise where the former noise cannot be distinguished from the relative phase induced from the target fields. However, we have found that we can improve the sensitivity if we adopt postselection to discard the state when error is detected. Even when quantum error detection is moderately noisy, and allowing for the cost of the postselection technique, we find that this two-qubit system shows an advantage in sensing over a single qubit in the same conditions.
Akos Varga-Szemes
Full Text Available MRI contrast agents (CA whose contrast enhancement remains relatively high even at the higher end of the magnetic field strength range would be desirable. The purpose of this work was to demonstrate such a desired magnetic field dependency of the longitudinal relaxivity for an experimental MRI CA, Gd(ABE-DTTA.The relaxivity of 0.5mM and 1mM Gd(ABE-DTTA was measured by Nuclear Magnetic Relaxation Dispersion (NMRD in the range of 0.0002 to 1T. Two MRI and five NMR instruments were used to cover the range between 1.5 to 20T. Parallel measurement of a Gd-DTPA sample was performed throughout as reference. All measurements were carried out at 37°C and pH 7.4.The relaxivity values of 0.5mM and 1mM Gd(ABE-DTTA measured at 1.5, 3, and 7T, within the presently clinically relevant magnetic field range, were 15.3, 11.8, 12.4 s-1mM-1 and 18.1, 16.7, and 13.5 s-1mM-1, respectively. The control 4 mM Gd-DTPA relaxivities at the same magnetic fields were 3.6, 3.3, and 3.0 s-1mM-1, respectively.The longitudinal relaxivity of Gd(ABE-DTTA measured within the presently clinically relevant field range is three to five times higher than that of most commercially available agents. Thus, Gd(ABE-DTTA could be a practical choice at any field strength currently used in clinical imaging including those at the higher end.
Highly reduced double-decker single-molecule magnets exhibiting slow magnetic relaxation.
Gonidec, Mathieu; Krivokapic, Itana; Vidal-Gancedo, Jose; Davies, E Stephen; McMaster, Jonathan; Gorun, Sergiu M; Veciana, Jaume
2013-04-15
F64Pc2Ln (1Ln, Ln = Tb or Lu) represent the first halogenated phthalocyanine double-decker lanthanide complexes, and 1Tb exhibits single-molecule magnet properties as revealed by solid-state magnetometry. The fluorine substituents of the phthalocyanine rings have a dramatic effect on the redox properties of the F64Pc2Ln complexes, namely, a stabilization of their reduced states. Electrochemical and spectroelectrochemical measurements demonstrate that the 1Tb(-/2-) and 1Tb(2-/3-) couples exhibit redox reversibility and that the 1Tb(-), 1Tb(2-) and 1Tb(3-) species may be prepared by bulk electrolysis in acetone. Low-temperature MCD studies reveal for the first time magnetization hystereses for the super-reduced dianionic and trianionic states of Pc2Ln.
Dynamics of Permanent-Magnet Biased Active Magnetic Bearings
Fukata, Satoru; Yutani, Kazuyuki
1996-01-01
Active magnetic radial bearings are constructed with a combination of permanent magnets to provide bias forces and electromagnets to generate control forces for the reduction of cost and the operating energy consumption. Ring-shaped permanent magnets with axial magnetization are attached to a shaft and share their magnet stators with the electromagnets. The magnet cores are made of solid iron for simplicity. A simplified magnetic circuit of the combined magnet system is analyzed with linear circuit theory by approximating the characteristics of permanent magnets with a linear relation. A linearized dynamical model of the control force is presented with the first-order approximation of the effects of eddy currents. Frequency responses of the rotor motion to disturbance inputs and the motion for impulsive forces are tested in the non-rotating state. The frequency responses are compared with numerical results. The decay of rotor speed due to magnetic braking is examined. The experimental results and the presented linearized model are similar to those of the all-electromagnetic design.
Ponzoni, Stefano
2014-10-16
By properly tuning the photon energy of a femtosecond laser pump, we disentangle, in carbon nanotube-Si (CNT/Si) heterojunctions, the fast relaxation dynamics occurring in CNT from the slow repopulation dynamics due to hole charge transfer at the junction. In this way we are able to track the transfer of the photogenerated holes from the Si depletion layer to the CNT layer, under the action of the built-in heterojunction potential. This also clarifies that CNT play an active role in the junction and do not act only as channels for charge collection and transport.
Ruggiero, Maria R.; Geninatti Crich, Simonetta; Sieni, Elisabetta; Sgarbossa, Paolo; Forzan, Michele; Cavallari, Eleonora; Stefania, Rachele; Dughiero, Fabrizio; Aime, Silvio
2016-07-01
Magnetic iron oxide nanoparticles (Fe-NPs) can be exploited in biomedicine as agents for magnetic fluid hyperthermia (MFH) treatments and as contrast enhancers in magnetic resonance imaging. New, oleate-covered, iron oxide particles have been prepared either by co-precipitation or thermal decomposition methods and incorporated into poly(lactic-co-glycolic acid) nanoparticles (PLGA-Fe-NPs) to improve their biocompatibility and in vivo stability. Moreover, the PLGA-Fe-NPs have been loaded with paclitaxel to pursue an MFH-triggered drug release. Remarkably, it has been found that the nanoparticle formulations are characterized by peculiar 1H nuclear magnetic relaxation dispersion (NMRD) profiles that directly correlate with their heating potential when exposed to an alternating magnetic field. By prolonging the magnetic field exposure to 30 min, a significant drug release was observed for PLGA-Fe-NPs in the case of the larger-sized magnetic nanoparticles. Furthermore, the immobilization of lipophilic Fe-NPs in PLGA-NPs also made it possible to maintain Néel relaxation as the dominant relaxation contribution in the presence of large iron oxide cores (diameters of 15-20 nm), with the advantage of preserving their efficiency when they are entrapped in the intracellular environment. The results reported herein show that NMRD profiles are a useful tool for anticipating the heating capabilities of Fe-NPs designed for MFH applications.
Mitchell, J.; Chandrasekera, T. C.
2014-12-01
The nuclear magnetic resonance transverse relaxation time T2, measured using the Carr-Purcell-Meiboom-Gill (CPMG) experiment, is a powerful method for obtaining unique information on liquids confined in porous media. Furthermore, T2 provides structural information on the porous material itself and has many applications in petrophysics, biophysics, and chemical engineering. Robust interpretation of T2 distributions demands appropriate processing of the measured data since T2 is influenced by diffusion through magnetic field inhomogeneities occurring at the pore scale, caused by the liquid/solid susceptibility contrast. Previously, we introduced a generic model for the diffusion exponent of the form -ant_e^k (where n is the number and te the temporal separation of spin echoes, and a is a composite diffusion parameter) in order to distinguish the influence of relaxation and diffusion in CPMG data. Here, we improve the analysis by introducing an automatic search for the optimum power k that best describes the diffusion behavior. This automated method is more efficient than the manual trial-and-error grid search adopted previously, and avoids variability through subjective judgments of experimentalists. Although our method does not avoid the inherent assumption that the diffusion exponent depends on a single k value, we show through simulation and experiment that it is robust in measurements of heterogeneous systems that violate this assumption. In this way, we obtain quantitative T2 distributions from complicated porous structures and demonstrate the analysis with examples of ceramics used for filtration and catalysis, and limestone of relevance to the construction and petroleum industries.
Mitchell, J., E-mail: JMitchell16@slb.com [Schlumberger Gould Research, High Cross, Madingley Road, Cambridge CB3 0EL (United Kingdom); Chandrasekera, T. C. [Department of Chemical Engineering and Biotechnology, University of Cambridge, Pembroke Street, Cambridge CB2 3RA (United Kingdom)
2014-12-14
The nuclear magnetic resonance transverse relaxation time T{sub 2}, measured using the Carr-Purcell-Meiboom-Gill (CPMG) experiment, is a powerful method for obtaining unique information on liquids confined in porous media. Furthermore, T{sub 2} provides structural information on the porous material itself and has many applications in petrophysics, biophysics, and chemical engineering. Robust interpretation of T{sub 2} distributions demands appropriate processing of the measured data since T{sub 2} is influenced by diffusion through magnetic field inhomogeneities occurring at the pore scale, caused by the liquid/solid susceptibility contrast. Previously, we introduced a generic model for the diffusion exponent of the form −ant{sub e}{sup k} (where n is the number and t{sub e} the temporal separation of spin echoes, and a is a composite diffusion parameter) in order to distinguish the influence of relaxation and diffusion in CPMG data. Here, we improve the analysis by introducing an automatic search for the optimum power k that best describes the diffusion behavior. This automated method is more efficient than the manual trial-and-error grid search adopted previously, and avoids variability through subjective judgments of experimentalists. Although our method does not avoid the inherent assumption that the diffusion exponent depends on a single k value, we show through simulation and experiment that it is robust in measurements of heterogeneous systems that violate this assumption. In this way, we obtain quantitative T{sub 2} distributions from complicated porous structures and demonstrate the analysis with examples of ceramics used for filtration and catalysis, and limestone of relevance to the construction and petroleum industries.
Apih, T.; Lebar, A.; Pawlig, O.; Trettin, R.
2001-06-01
Proton nuclear magnetic relaxation is a well-established technique for continuous and non destructive monitoring of hydration of conventional Portland building cements. Here, we demonstrate the feasibility of nuclear magnetic resonance (NMR) monitoring of the setting reaction of zinc-phosphate acid-base dental cements, which harden in minutes as compared to days, as in the case of Portland cements. We compare the setting of cement powder (mainly, zinc oxide) prepared with clinically used aluminum-modified orthophosphoric acid solution with the setting of a model system where cement powder is mixed with pure orthophosphoric acid solution. In contrast to previously published NMR studies of setting Portland cements, where a decrease of spin-lattice relaxation time is attributed to enhanced relaxation at the growing internal surface, spin-lattice relaxation time T1 increases during the set of clinically used zinc-phosphate cement. Comparison of these results with a detailed study of diffusion, viscosity, and magnetic-field dispersion of T1 in pure and aluminum-modified orthophosphoric acid demonstrates that the increase of T1 in the setting cement is connected with the increase of molecular mobility in the residual phosphoric acid solution. Although not taken into account so far, such effects may also significantly influence the relaxation times in setting Portland cements, particularly when admixtures with an effect on water viscosity are used.
Wan Xuewen; Kossler, William J.; Stronach, Carey E.; Noakes, David R. [College of William and Mary, Physics Department (United States)
1999-11-15
Zero-field muon spin relaxation (ZF-{mu}SR) data for dilute spin magnetic systems have been widely interpreted with what is called a Kubo-Toyabe form based on a Lorentzian distribution of local field components. We derive here the proper magnetic field magnitude distribution using independent and uncorrelated component distributions. Our result is then compared to the previously accepted formula for ZF-{mu}SR. We discuss the origins of the magnetic field component and magnitude distributions. Further, we found that after rescaling the magnetic field, the differences that are amenable to experimental examination are quite small, although the interpretations behind them are quite different.
Storchak, Vyacheslav G; Eshchenko, Dmitry G; Morenzoni, Elvezio; Prokscha, Thomas; Suter, Andreas; Liu, Xinyu; Furdyna, Jacek K
2008-07-11
Thin epitaxial films of the diluted magnetic semiconductor (DMS) GaMnAs have been studied by low energy muon spin rotation and relaxation (LE-microSR) as well as by transport and magnetization measurement techniques. LE-microSR allows measurements of the distribution of magnetic field on the nanometer scale inaccessible to traditional macroscopic techniques. The spatial inhomogeneity of the magnetic field is resolved: although homogeneous above Tc, below Tc the DMS consists of ferromagnetic and paramagnetic regions of comparable volumes. In the ferromagnetic regions the local field inhomogeneity amounts to 0.03 T.
Liu, Huabing; Nogueira d'Eurydice, Marcel; Obruchkov, Sergei; Galvosas, Petrik
2014-09-01
Pore length scales and pore surface relaxivities of rock cores with different lithologies were studied on a 2MHz Rock Core Analyzer. To determine the pore length scales of the rock cores, the high eigenmodes of spin bearing molecules satisfying the diffusion equation were detected with optimized encoding periods in the presence of internal magnetic fields Bin. The results were confirmed using a 64MHz NMR system, which supports the feasibility of high eigenmode detection at fields as low as 2MHz. Furthermore, this methodology was combined with relaxometry measurements to a two-dimensional experiment, which provides correlation between pore length and relaxation time. This techniques also yields information on the surface relaxivity of the rock cores. The estimated surface relaxivities were then compared to the results using an independent NMR method.
Magnetic nanoparticles in fluid environment: combining molecular dynamics and Lattice-Boltzmann
Melenev, Petr
2017-06-01
Hydrodynamic interactions between magnetic nanoparticles suspended in the Newtonian liquid are accounted for using a combination of the lattice Boltzmann method and molecular dynamics simulations. Nanoparticle is modelled by the system of molecular dynamics material points (which form structure resembles raspberry) coupled to the lattice Boltzmann fluid. The hydrodynamic coupling between the colloids is studied by simulations of the thermo-induced rotational diffusion of two raspberry objects. It was found that for the considered range of model parameters the approaching of the raspberries leads to slight retard of the relaxation process. The presence of the weak magnetic dipolar interaction between the objects leads to modest decrease of the relaxation time and the extent of the acceleration of the diffusion is intensified along with magnetic forces.
Nonlinear Dynamics of A Damped Magnetic Oscillator
Kim, S Y
1999-01-01
We consider a damped magnetic oscillator, consisting of a permanent magnet in a periodically oscillating magnetic field. A detailed investigation of the dynamics of this dissipative magnetic system is made by varying the field amplitude $A$. As $A$ is increased, the damped magnetic oscillator, albeit simple looking, exhibits rich dynamical behaviors such as symmetry-breaking pitchfork bifurcations, period-doubling transitions to chaos, symmetry-restoring attractor-merging crises, and saddle-node bifurcations giving rise to new periodic attractors. Besides these familiar behaviors, a cascade of ``resurrections'' (i.e., an infinite sequence of alternating restabilizations and destabilizations) of the stationary points also occurs. It is found that the stationary points restabilize (destabilize) through alternating subcritical (supercritical) period-doubling and pitchfork bifurcations. We also discuss the critical behaviors in the period-doubling cascades.
Dynamical properties of unconventional magnetic systems
Helgesen, G. [ed.
1997-05-01
The Advanced Study Institute addressed the current experimental and theoretical knowledge of the dynamical properties of unconventional magnetic systems including low-dimensional and mesoscopic magnetism, unconventional ground state, quantum magnets and soft matter. The main approach in this Advanced Study Institute was to obtain basic understanding of co-operative phenomena, fluctuations and excitations in the wide range unconventional magnetic systems now being fabricated or envisioned. The report contains abstracts for lectures, invited seminars and posters, together with a list of the 95 participants from 24 countries with e-mail addresses
Beardsley, R. P.; Parkes, D. E.; Zemen, J.; Bowe, S.; Edmonds, K. W.; Reardon, C.; Maccherozzi, F.; Isakov, I.; Warburton, P. A.; Campion, R. P.; Gallagher, B. L.; Cavill, S. A.; Rushforth, A. W.
2017-02-01
We investigate the role of lithographically-induced strain relaxation in a micron-scaled device fabricated from epitaxial thin films of the magnetostrictive alloy Fe81Ga19. The strain relaxation due to lithographic patterning induces a magnetic anisotropy that competes with the magnetocrystalline and shape induced anisotropies to play a crucial role in stabilising a flux-closing domain pattern. We use magnetic imaging, micromagnetic calculations and linear elastic modelling to investigate a region close to the edges of an etched structure. This highly-strained edge region has a significant influence on the magnetic domain configuration due to an induced magnetic anisotropy resulting from the inverse magnetostriction effect. We investigate the competition between the strain-induced and shape-induced anisotropy energies, and the resultant stable domain configurations, as the width of the bar is reduced to the nanoscale range. Understanding this behaviour will be important when designing hybrid magneto-electric spintronic devices based on highly magnetostrictive materials.
On-chip measurements of Brownian relaxation of magnetic beads with diameters from 10 nm to 250 nm
Østerberg, Frederik Westergaard; Rizzi, Giovanni; Hansen, Mikkel Fougt
2013-01-01
We demonstrate the use of planar Hall effect magnetoresistive sensors for AC susceptibility measurements of magnetic beads with frequencies ranging from DC to 1 MHz. This wide frequency range allows for measuring Brownian relaxation of magnetic beads with diameters ranging from 10 nm to 250 nm...... to sedimentation, magnetic trapping, and signal per bead. Among the investigated beads, we conclude that the beads with a nominal diameter of 80 nm are best suited for future on-chip volume-based biosensing experiments using planar Hall effect sensors........ Brownian relaxation is measured for six different magnetic bead types and their hydrodynamic diameters are determined. The hydrodynamic diameters are found to be within 40% of the nominal bead diameters. We discuss the applicability of the different bead types for volume-based biosensing with respect...
Nonlinear damping effects in spin torque dynamics of magnetic tunnel junctions
Barsukov, Igor; Chen, Yu-Jin; Lee, Han Kyu; Goncalves, Alexandre; Katine, Jordan; Arias, Rodrigo; Ivanov, Boris; Krivorotov, Ilya
2015-03-01
Performance of nanoscale spin torque devices such as memory (STT-MRAM) and auto-oscillators critically depends on magnetic relaxation. It is commonly assumed that magnetization dynamics in the presence of spin torque can be understood as simple competition between antidamping arising from spin torque and Gilbert damping of the free layer. However our experiments reveal that the situation is more complex and that nonlinear damping processes in the free layer of magnetic tunnel junction (MTJ) nanopillars can strongly alter spin torque driven dynamics. We study elliptical MTJ nanopillars with in-plane magnetizations of the free layer and SAF layers by spin torque ferromagnetic resonance. We find an excitation spectrum associated with standing spin waves of the free layer. By varying the external field, the energy of a higher-order spin wave mode becomes twice the energy of the main mode. This opens up a nonlinear, resonant relaxation channel, giving rise to a damping increase of approximately 20 percent. With increasing spin torque provided by a DC bias current, we find that this relaxation channel competes with antidamping in a nonlinear manner, increasingly contributing to and even dominating the relaxation at subcritical currents.
Tarrío-Saavedra, Javier; González, Cécilia Galindo; Naya, Salvador; López-Beceiro, Jorge
2017-01-01
This study investigated a methodology based on image processing and statistics to characterize and model the deformation upon controlled and uniform magnetic field and the relaxation under zero field of droplets observed in aqueous solutions of sodium alginate incorporating magnetic maghemite nanoparticles stabilized by adsorption of citrate ions. The changes of droplet geometry were statistically analyzed using a new approach based on the data obtained from optical microscopy, image processing, nonlinear regression, evolutionary optimization, analysis of variance and resampling. Image enhancement and then image segmentation (Gaussian mixture modeling) processes were applied to extract features with reliable information of droplets dimensions from optical micrographs. The droplets deformation and relaxation trends were accurately adjusted by the Kohlrausch-Williams-Watts (KWW) function and a mean relaxation time was obtained by fitting the time evolution of geometry parameters. It was found to be proportional to the initial radius of the spherical droplets and was associated to interfacial tension. PMID:28081239
Greene, Patrick T.; Schofield, Samuel P.; Nourgaliev, Robert
2017-04-01
A new mesh smoothing method designed to cluster cells near a dynamically evolving interface is presented. The method is based on weighted condition number mesh relaxation with the weight function computed from a level set representation of the interface. The weight function is expressed as a Taylor series based discontinuous Galerkin projection, which makes the computation of the derivatives of the weight function needed during the condition number optimization process a trivial matter. For cases when a level set is not available, a fast method for generating a low-order level set from discrete cell-centered fields, such as a volume fraction or index function, is provided. Results show that the low-order level set works equally well as the actual level set for mesh smoothing. Meshes generated for a number of interface geometries are presented, including cases with multiple level sets. Dynamic cases with moving interfaces show the new method is capable of maintaining a desired resolution near the interface with an acceptable number of relaxation iterations per time step, which demonstrates the method's potential to be used as a mesh relaxer for arbitrary Lagrangian Eulerian (ALE) methods.
Greene, Patrick; Schofield, Sam; Nourgaliev, Robert
2016-11-01
A new mesh smoothing method designed to cluster cells near a dynamically evolving interface is presented. The method is based on weighted condition number mesh relaxation with the weight function being computed from a level set representation of the interface. The weight function is expressed as a Taylor series based discontinuous Galerkin (DG) projection, which makes the computation of the derivatives of the weight function needed during the condition number optimization process a trivial matter. For cases when a level set is not available, a fast method for generating a low-order level set from discrete cell-centered fields, such as a volume fraction or index function, is provided. Results show that the low-order level set works equally well for the weight function as the actual level set. The method retains the excellent smoothing capabilities of condition number relaxation, while providing a method for clustering mesh cells near regions of interest. Dynamic cases for moving interfaces are presented to demonstrate the method's potential usefulness as a mesh relaxer for arbitrary Lagrangian Eulerian (ALE) methods. This work was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract DE-AC52-07NA27344.
Viscosity, relaxation time, and dynamics within a model asphalt of larger molecules
Li, Derek D.; Greenfield, Michael L.
2014-01-01
The dynamics properties of a new "next generation" model asphalt system that represents SHRP AAA-1 asphalt using larger molecules than past models is studied using molecular simulation. The system contains 72 molecules distributed over 12 molecule types that range from nonpolar branched alkanes to polar resins and asphaltenes. Molecular weights range from 290 to 890 g/mol. All-atom molecular dynamics simulations conducted at six temperatures from 298.15 to 533.15 K provide a wealth of correlation data. The modified Kohlrausch-Williams-Watts equation was regressed to reorientation time correlation functions and extrapolated to calculate average rotational relaxation times for individual molecules. The rotational relaxation rate of molecules decreased significantly with increasing size and decreasing temperature. Translational self-diffusion coefficients followed an Arrhenius dependence. Similar activation energies of ˜42 kJ/mol were found for all 12 molecules in the model system, while diffusion prefactors spanned an order of magnitude. Viscosities calculated directly at 533.15 K and estimated at lower temperatures using the Debye-Stokes-Einstein relationship were consistent with experimental data for asphalts. The product of diffusion coefficient and rotational relaxation time showed only small changes with temperature above 358.15 K, indicating rotation and translation that couple self-consistently with viscosity. At lower temperatures, rotation slowed more than diffusion.
Viscosity, relaxation time, and dynamics within a model asphalt of larger molecules
Li, Derek D.; Greenfield, Michael L., E-mail: greenfield@egr.uri.edu [Department of Chemical Engineering, University of Rhode Island, Kingston, Rhode Island 02881 (United States)
2014-01-21
The dynamics properties of a new “next generation” model asphalt system that represents SHRP AAA-1 asphalt using larger molecules than past models is studied using molecular simulation. The system contains 72 molecules distributed over 12 molecule types that range from nonpolar branched alkanes to polar resins and asphaltenes. Molecular weights range from 290 to 890 g/mol. All-atom molecular dynamics simulations conducted at six temperatures from 298.15 to 533.15 K provide a wealth of correlation data. The modified Kohlrausch-Williams-Watts equation was regressed to reorientation time correlation functions and extrapolated to calculate average rotational relaxation times for individual molecules. The rotational relaxation rate of molecules decreased significantly with increasing size and decreasing temperature. Translational self-diffusion coefficients followed an Arrhenius dependence. Similar activation energies of ∼42 kJ/mol were found for all 12 molecules in the model system, while diffusion prefactors spanned an order of magnitude. Viscosities calculated directly at 533.15 K and estimated at lower temperatures using the Debye-Stokes-Einstein relationship were consistent with experimental data for asphalts. The product of diffusion coefficient and rotational relaxation time showed only small changes with temperature above 358.15 K, indicating rotation and translation that couple self-consistently with viscosity. At lower temperatures, rotation slowed more than diffusion.
Multi-probe relaxation dispersion measurements increase sensitivity to protein dynamics.
Fenwick, R Bryn; Oyen, David; Wright, Peter E
2016-02-17
Carr-Purcell-Meiboom-Gill (CPMG) relaxation dispersion measurements are a valuable tool for the characterization of structural transitions on the micro-millisecond timescale. While the measurement of (15)N relaxation dispersion is now routine, the measurements with alternative nuclei remain limited. Here we report (15)N as well as (1)H R2 relaxation dispersion measurements of the N23PP/S148A "dynamic knockout" mutant of dihydrofolate reductase. The (1)H dispersion measurements are complementary to (15)N data as many additional residues are observed to have dispersive behavior for the (1)H nucleus. Simultaneous fitting of the dispersion profiles for the two nuclei increases the accuracy of exchange parameters determined for individual residues and clustered groups of residues. The different sensitivity of the two nuclei to changes in backbone torsional angles, ring currents, and hydrogen bonding effects provides important insights into the nature of the structural changes that take place during the exchange process. We observe clear evidence of direct and indirect hydrogen bond effects for the (15)N and (1)H chemical shift changes in the active-site, modulation of ring current shielding in the CD-loop and backbone torsional changes in a cluster of residues associated with the C-terminus. This work demonstrates the power of combined (1)H and (15)N probes for the study of backbone dynamics on the micro-millisecond timescale though the analysis of chemical shift changes.
Lu, Wei; Liu, Xuefeng; Lu, Hong; Li, Caizhen; Lai, Jiawei; Zhao, Chuan; Tian, Ye; Liao, Zhimin; Jia, Shuang; Sun, Dong
2016-01-01
Three dimensional (3D) Dirac semimetal exhibiting ultrahigh mobility has recently attracted enormous research interests as 3D analogues of graphene. From the prospects of future application toward electronic/optoelectronic devices with extreme performance, it is crucial to understand the relaxation dynamics of photo-excited carriers and their coupling with lattice. In this work, we report ultrafast transient reflection measurements of photo-excited carrier dynamics in cadmium arsenide (Cd3As2), which is among the most stable Dirac semimetals that have been confirmed experimentally. With low energy probe photon of 0.3 eV, photo-excited Dirac Fermions dynamics closing to Dirac point are probed. Through transient reflection measurements on bulk and nanoplate samples that have different doping intensities, and systematic probe wavelength, pump power and lattice temperature dependent measurements, the dynamical evolution of carrier distributions can be retrieved qualitatively using a two-temperature model. The pho...
Slow magnetic relaxation in a hydrogen-bonded 2D array of mononuclear dysprosium(III) oxamates.
Fortea-Pérez, Francisco R; Vallejo, Julia; Julve, Miguel; Lloret, Francesc; De Munno, Giovanni; Armentano, Donatella; Pardo, Emilio
2013-05-01
The reaction of N-(2,6-dimethylphenyl)oxamic acid with dysprosium(III) ions in a controlled basic media afforded the first example of a mononuclear lanthanide oxamate complex exhibiting a field-induced slow magnetic relaxation behavior typical of single-ion magnets (SIMs). The hydrogen-bond-mediated self-assembly of this new bifunctional dysprosium(III) SIM in the solid state provides a unique example of 2D hydrogen-bonded polymer with a herringbone net topology.
Wang, Zhengjun; Seehra, Mohindar S.
2016-04-01
Previous magnetic studies in the organic semiconductor β-manganese phthalocyanine (β-MnPc) have reported it to be a canted ferromagnet below T C ≈ 8.6 K. However, the recent result of the lack of a λ-type anomaly in the specific heat versus temperature data near the quoted T C has questioned the presence of long-range 3-dimensional (3D) magnetic ordering in this system. In this paper, detailed measurements and analysis of the temperature (2 K-300 K) and magnetic field (up to 90 kOe) dependence of the dc and ac magnetic susceptibilities in a powder sample of β-MnPc leads us to conclude that 3D long-range magnetic ordering is absent in this material. This is supported by the Arrott plots and the lack of a peak in the ac susceptibilities, χ‧ and χ″, near the quoted T C. Instead, the system can be best described as an Ising-like chain magnet with Arrhenius relaxation of the magnetization governed by an intra-layer ferromagnetic exchange constant J/k B = 2.6 K and the single ion anisotropy energy parameter |D|/k B = 8.3 K. The absence of 3D long range order is consistent with the measured \\mid D\\mid > J.
Wang, Zhengjun; Seehra, Mohindar S
2016-04-06
Previous magnetic studies in the organic semiconductor β-manganese phthalocyanine (β-MnPc) have reported it to be a canted ferromagnet below T(C) ≈ 8.6 K. However, the recent result of the lack of a λ-type anomaly in the specific heat versus temperature data near the quoted T(C) has questioned the presence of long-range 3-dimensional (3D) magnetic ordering in this system. In this paper, detailed measurements and analysis of the temperature (2 K-300 K) and magnetic field (up to 90 kOe) dependence of the dc and ac magnetic susceptibilities in a powder sample of β-MnPc leads us to conclude that 3D long-range magnetic ordering is absent in this material. This is supported by the Arrott plots and the lack of a peak in the ac susceptibilities, χ' and χ″, near the quoted T(C). Instead, the system can be best described as an Ising-like chain magnet with Arrhenius relaxation of the magnetization governed by an intra-layer ferromagnetic exchange constant J/k(B) = 2.6 K and the single ion anisotropy energy parameter |D|/k(B) = 8.3 K. The absence of 3D long range order is consistent with the measured |D|/ > J.
Katoh, Keiichi; Aizawa, Yu; Morita, Takaumi; Breedlove, Brian K; Yamashita, Masahiro
2017-08-07
When applying single-molecule magnets (SMMs) to spintronic devices, control of the quantum tunneling of the magnetization (QTM) as well as a spin-lattice interactions are important. Attempts have been made to use not only coordination geometry but also magnetic interactions between SMMs as an exchange bias. In this manuscript, dinuclear dysprosium(III) (Dy(III) ) SMMs with the same octacoordination geometry undergo dual magnetic relaxation processes at low temperature. In the dinuclear Dy(III) phthalocyaninato (Pc(2-) ) triple-decker type complex [(Pc)Dy(ooPc)Dy(Pc)] (1) (ooPc(2-) =2,3,9,10,16,17,23,24-octakis(octyloxy)phthalocyaninato) with a square-antiprismatic (SAP) geometry, the ground state is divided by the Zeeman effect, and level intersection occurs when a magnetic field is applied. Due to the ground state properties of 1, since the Zeeman diagram where the levels intersect in an Hdc of 2500 Oe, two kinds of QTM and direct processes occur. However, dinuclear Dy(III) -Pc systems with C4 geometry, which have a twist angle (ϕ) of less than 45° do not undergo dual magnetic relaxation processes. From magnetic field and temperature dependences, the dual magnetic relaxation processes were clarified. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.
Histidine side-chain dynamics and protonation monitored by C-13 CPMG NMR relaxation dispersion
Hass, M. A. S.; Yilmaz, A.; Christensen, Hans Erik Mølager;
2009-01-01
The use of C-13 NMR relaxation dispersion experiments to monitor micro-millisecond fluctuations in the protonation states of histidine residues in proteins is investigated. To illustrate the approach, measurements on three specifically C-13 labeled histidine residues in plastocyanin (PCu) from...... Anabaena variabilis (A.v.) are presented. Significant Carr-Purcell-Meiboom-Gill (CPMG) relaxation dispersion is observed for C-13(epsilon 1) nuclei in the histidine imidazole rings of A.v. PCu. The chemical shift changes obtained from the CPMG dispersion data are in good agreement with those obtained from...... or other kinds of conformational changes of histidine side chains or their environment. Advantages and shortcomings of using the C-13(epsilon 1) dispersion experiments in combination with chemical shift titration experiments to obtain information on exchange dynamics of the histidine side chains...
A subzero 1H NMR relaxation investigation of water dynamics in tomato pericarp.
Foucat, Loïc; Lahaye, Marc
2014-09-01
(1)H NMR relaxation times (T1 and T2) were measured at low field (0.47 T) in pericarp tissues of three tomato genotypes (Ferum, LA0147 and Levovil) at subzero temperature (-20 °C) and two ripening stages (mature green and red). The unfrozen water dynamics was characterised by two T1 and three T2 components. The relaxation time values and their associated relative populations allowed differentiating the ripening stage of only LA0147 and Levovil lines. But the three genotypes were unequivocally discriminated at the red ripe stage. The unfrozen water distribution was discussed in terms of specific interactions, especially with sugars, in relation with their osmoprotectant effects.
Femtosecond Transient Absorption Spectra and Relaxation Dynamics of SWNT in SDS Micellar Solutions
Nadtochenko, V. A.; Lobach, A. S.; Gostev, F. E.; Tcherbinin, D. O.; Sobennikov, A.; Sarkisov, O. M.
2005-09-01
Transient absorption spectra and relaxation dynamics of excited SWNT were studied by femtosecond absorption spectroscopy as a function of: the energy of excitation quanta (ℏω = 2 eV, 2.5 eV, 4 eV); the density of the excitation energy; polarizations of the pump and probe pulses. The transient absorption spectra were monitored by white supercontinuum light pulse in the spectral region of ˜ 1.2 ÷ 3.6 eV. The induced transient absorption spectra of SWNT are considered as filling of the size-quantized energy bands with nonequilibrium carriers; renormalization of the one-dimensional energy bands at high density of the induced plasma; quantum confined Stark effect and screening of excitons. The anisotropic relaxation rate is observed.
(14)N NQR, relaxation and molecular dynamics of the explosive TNT.
Smith, John A S; Rowe, Michael D; Althoefer, Kaspar; Peirson, Neil F; Barras, Jamie
2015-10-01
Multiple pulse sequences are widely used for signal enhancement in NQR detection applications. Since the various (14)N NQR relaxation times, signal decay times and frequency of each NQR line have a major influence on detection sequence performance, it is important to characterise these parameters and their temperature variation, as fully as possible. In this paper we discuss such measurements for a number of the ν+ and ν- NQR lines of monoclinic and orthorhombic TNT and relate the temperature variation results to molecular dynamics. The temperature variation of the (14)N spin-lattice relaxation times T1 is interpreted as due to hindered rotation of the NO2 group about the C-NO2 bond with an activation energy of 89 kJ mol(-1) for the ortho and para groups of monoclinic TNT and 70 kJ mol(-1) for the para group of orthorhombic TNT.
Picosecond Dynamic Heterogeneity, Hopping, and Johari-Goldstein Relaxation in Glass-Forming Liquids
Cicerone, Marcus T.; Zhong, Qin; Tyagi, Madhusudan
2014-09-01
We show that incoherent quasielastic neutron scattering from molecular liquids reveals a two-state dynamic heterogeneity on a 1 ps time scale, where molecules are either highly confined or are free to undergo relatively large excursions. Data ranging from deep in the glassy state to well above the melting point allows us to observe temperature-dependent population levels and exchange between these two states. A simple physical picture emerges from this data, combined with published work, that provides a mechanism for hopping and for the Johari-Goldstein (βJG) relaxation, and allows us to accurately calculate the diffusion coefficient, DT, and characteristic times for α, and βJG relaxations from ps time scale neutron data.
Ishii, Masashi
2010-09-01
For dynamic analyses of a polymer surface, a dielectric relaxation measurement technique with parallel electrodes placed away from the surface was developed. In this technique, a liquid heating medium was filled in the space between the polymer surface and the electrodes. The construction that maintains the surface can clarify the physical interactions between the liquid and the bare surface and controlling the temperature of the liquid reveals the thermal activation property of the surface. The dielectric relaxation spectrum of the surface convoluted into the bulk and liquid spectra can be obtained by a reactance analysis and the surface spectrum is expressed with an equivalent resistance-capacitance parallel circuit. On the basis of the electromechanical analogy, the electric elements can be converted into mechanical elements that indicate the viscoelasticity of the polymer surface. Using these measurement and analysis techniques, the electric and mechanical properties of the surface of a gelatinized chloroprene rubber sample were analyzed.
Relaxation dynamics of a polymer network modeled by a multihierarchical structure.
Jurjiu, A; Volta, A; Beu, T
2011-07-01
We numerically analyze the scaling behavior of experimentally accessible dynamical relaxation forms for polymer networks modeled by a finite multihierarchical structure. In the framework of generalized Gaussian structures, by making use of the eigenvalue spectrum of the connectivity matrix, we determine the averaged monomer displacement under local external forces as well as the mechanical relaxation quantities (storage and loss moduli). Hence we generalize the known analysis for both classes of fractals to the case of multihierarchical structure, for which even though we have a mixed growth algorithm, the above cited observables still give information about the two different underlying topologies. For very large lattices, reached via an algebraic procedure that avoids the numerical diagonalizations of the corresponding connectivity matrices, we depict the scaling of both component fractals in the intermediate time (frequency) domain, which manifests two different slopes.
Dynamic shielding of the magnetic fields
RAU, M.
2010-11-01
Full Text Available The paper presents a comparative study of the methods used to control and compensate the direct and alternative magnetic fields. Two frequently used methods in the electromagnetic compatibility of the complex biomagnetism installations were analyzed. The two methods refer to the use of inductive magnetic field sensors (only for alternative fields and of fluxgate magnetometers as active transducers which measures both the direct and alternative components of the magnetic field. The applications of the dynamic control of the magnetic field are: control of the magnetic field of the military ships, control of parasite magnetic field produced by power transformers and the electrical networks, protection of the mass spectrometers, electronic microscopes, SQUID and optical pumping magnetometers for applications in biomagnetism.
Dynamical quenching of tunneling in molecular magnets
José Santander, María, E-mail: maria.jose.noemi@gmail.com [Recursos Educativos Quántica, Santiago (Chile); Departamento de Física, Universidad de Santiago de Chile and CEDENNA, Avda. Ecuador 3493, Santiago (Chile); Nunez, Alvaro S., E-mail: alnunez@dfi.uchile.cl [Departamento de Física, Facultad de Ciencias Físicas y Matemáticas, Universidad de Chile, Casilla 487-3, Santiago (Chile); Roldán-Molina, A. [Instituto de Física, Pontificia Universidad Católica de Valparaíso, Avenida Universidad 330, Curauma, Valparaíso (Chile); Troncoso, Roberto E., E-mail: r.troncoso.c@gmail.com [Centro para el Desarrollo de la Nanociencia y la Nanotecnología, CEDENNA, Avda. Ecuador 3493, Santiago 9170124 (Chile); Departamento de Física, Universidad Técnica Federico Santa María, Avenida España 1680, Valparaíso (Chile)
2015-12-15
It is shown that a single molecular magnet placed in a rapidly oscillating magnetic field displays the phenomenon of quenching of tunneling processes. The results open a way to manipulate the quantum states of molecular magnets by means of radiation in the terahertz range. Our analysis separates the time evolution into slow and fast components thereby obtaining an effective theory for the slow dynamics. This effective theory presents quenching of the tunnel effect, in particular, stands out its difference with the so-called coherent destruction of tunneling. We support our prediction with numerical evidence based on an exact solution of Schrödinger's equation. - Highlights: • Single molecular magnets under rapidly oscillating magnetic fields is studied. • It is shown that this system displays the quenching of tunneling processes. • Our findings provide a control of quantum molecular magnets via terahertz radiation.
Moshchalcov, V. V.; Zhukov, A. A.; Kuznetzov, V. D.; Metlushko, V. V.; Leonyuk, L. I.
1990-01-01
At the initial time intervals, preceding the thermally activated flux creep regime, fast nonlogarithmic relaxation is found. The fully magnetic moment Pm(t) relaxation curve is shown. The magnetic measurements were made using SQUID-magnetometer. Two different relaxation regimes exist. The nonlogarithmic relaxation for the initial time intervals may be related to the viscous Abrikosov vortices flow with j is greater than j(sub c) for high enough temperature T and magnetic field induction B. This assumption correlates with Pm(t) measurements. The characteristic time t(sub O) separating two different relaxation regimes decreases as temperature and magnetic field are lowered. The logarithmic magnetization relaxation curves Pm(t) for fixed temperature and different external magnetic field inductions B are given. The relaxation rate dependence on magnetic field, R(B) = dPm(B, T sub O)/d(1nt) has a sharp maximum which is similar to that found for R(T) temperature dependences. The maximum shifts to lower fields as temperature goes up. The observed sharp maximum is related to a topological transition in shielding critical current distribution and, consequently, in Abrikosov vortices density. The nonlogarithmic magnetization relaxation for the initial time intervals is found. This fast relaxation has almost an exponentional character. The sharp relaxation rate R(B) maximum is observed. This maximum corresponds to a topological transition in Abrikosov vortices distribution.
Dynamics of Magnetic Nanoparticles Studied by Neutron Scattering
Hansen, Mikkel Fougt; Bødker, Franz; Mørup, Steen
1997-01-01
We present the first triple-axis neutron scattering measurements of magnetic fluctuations in nanoparticles using an antiferromagnetic reflection. Both the superparamagnetic relaxation and precession modes in similar to 15 nm hematite particles are: observed. The results have been consistently...
Magnetic Field Control of Combustion Dynamics
Barmina, I.; Valdmanis, R.; Zake, M.; Kalis, H.; Marinaki, M.; Strautins, U.
2016-08-01
Experimental studies and mathematical modelling of the effects of magnetic field on combustion dynamics at thermo-chemical conversion of biomass are carried out with the aim of providing control of the processes developing in the reaction zone of swirling flame. The joint research of the magnetic field effect on the combustion dynamics includes the estimation of this effect on the formation of the swirling flame dynamics, flame temperature and composition, providing analysis of the magnetic field effects on the flame characteristics. The results of experiments have shown that the magnetic field exerts the influence on the flow velocity components by enhancing a swirl motion in the flame reaction zone with swirl-enhanced mixing of the axial flow of volatiles with cold air swirl, by cooling the flame reaction zone and by limiting the thermo-chemical conversion of volatiles. Mathematical modelling of magnetic field effect on the formation of the flame dynamics confirms that the electromagnetic force, which is induced by the electric current surrounding the flame, leads to field-enhanced increase of flow vorticity by enhancing mixing of the reactants. The magnetic field effect on the flame temperature and rate of reactions leads to conclusion that field-enhanced increase of the flow vorticity results in flame cooling by limiting the chemical conversion of the reactants.
Three-dimensional gyrokinetic simulation of the relaxation of a magnetized temperature filament
Sydora, R. D.; Morales, G. J.; Maggs, J. E.; Van Compernolle, B.
2015-10-01
An electromagnetic, 3D gyrokinetic particle code is used to study the relaxation of a magnetized electron temperature filament embedded in a large, uniform plasma of lower temperature. The study provides insight into the role played by unstable drift-Alfvén waves observed in a basic electron heat transport experiment [D. C. Pace et al., Phys. Plasmas 15, 122304 (2008)] in which anomalous cross-field transport has been documented. The simulation exhibits the early growth of temperature-gradient-driven, drift-Alfvén fluctuations that closely match the eigenmodes predicted by linear theory. At the onset of saturation, the unstable fluctuations display a spiral spatial pattern, similar to that observed in the laboratory, which causes the rearrangement of the temperature profile. After saturation of the linear instability, the system exhibits a markedly different behavior depending on the inclusion in the computation of modes without variation along the magnetic field, i.e., kz = 0. In their absence, the initial filament evolves into a broadened temperature profile, self-consistent with undamped, finite amplitude drift-Alfvén waves. But the inclusion of kz = 0 modes causes the destruction of the filament and damping of the drift-Alfvén modes leading to a final state consisting of undamped convective cells and multiple, smaller-scale filaments.
Assi, Hiba; Dobramysl, Ulrich; Pleimling, Michel; Täuber, Uwe
2014-03-01
Technological applications of type-II superconductors require a deep understanding of the dynamics of vortex matter in these complex materials. We model vortices in the London limit as interacting elastic lines, and simulate their dynamics employing a Langevin molecular dynamics (LMD) algorithm. This LMD algorithm is utilized to investigate the non-equilibrium relaxation properties of interacting lines, subject to randomly-placed point or correlated columnar pinning sites, by studying various two-time correlation functions. We consider experimentally-motivated initial conditions by applying quenches in the system temperature or the magnetic field, which is realized by suddenly adding or removing vortex lines from the system. Research supported by the U.S. Department of Energy, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering under Award DE-FG02-09ER46613.
Dynamics of Magnetized Plasma Jets and Bubbles Launched into a Background Magnetized Plasma
Wallace, B.; Zhang, Y.; Fisher, D. M.; Gilmore, M.
2016-10-01
The propagation of dense magnetized plasma, either collimated with mainly azimuthal B-field (jet) or toroidal with closed B-field (bubble), in a background plasma occurs in a number of solar and astrophysical cases. Such cases include coronal mass ejections moving in the background solar wind and extragalactic radio lobes expanding into the extragalactic medium. Understanding the detailed MHD behavior is crucial for correctly modeling these events. In order to further the understanding of such systems, we are investigating the injection of dense magnetized jets and bubbles into a lower density background magnetized plasma using a coaxial plasma gun and a background helicon or cathode plasma. In both jet and bubble cases, the MHD dynamics are found to be very different when launched into background plasma or magnetic field, as compared to vacuum. In the jet case, it is found that the inherent kink instability is stabilized by velocity shear developed due to added magnetic tension from the background field. In the bubble case, rather than directly relaxing to a minimum energy Taylor state (spheromak) as in vacuum, there is an expansion asymmetry and the bubble becomes Rayleigh-Taylor unstable on one side. Recent results will be presented. Work supported by the Army Research Office Award No. W911NF1510480.
Uranga-Piña, L. [Facultad de Física, Universidad de la Habana, San Lázaro y L, Vedado, 10400 Havana (Cuba); Institute for Chemistry and Biochemistry, Freie Universität Berlin, Takustr. 3, D-14195 Berlin (Germany); Tremblay, J. C., E-mail: jean.c.tremblay@gmail.com [Institute for Chemistry and Biochemistry, Freie Universität Berlin, Takustr. 3, D-14195 Berlin (Germany)
2014-08-21
We investigate the effect of inter-mode coupling on the vibrational relaxation dynamics of molecules in weak dissipative environments. The simulations are performed within the reduced density matrix formalism in the Markovian regime, assuming a Lindblad form for the system-bath interaction. The prototypical two-dimensional model system representing two CO molecules approaching a Cu(100) surface is adapted from an ab initio potential, while the diatom-diatom vibrational coupling strength is systematically varied. In the weak system-bath coupling limit and at low temperatures, only first order non-adiabatic uni-modal coupling terms contribute to surface-mediated vibrational relaxation. Since dissipative dynamics is non-unitary, the choice of representation will affect the evolution of the reduced density matrix. Two alternative representations for computing the relaxation rates and the associated operators are thus compared: the fully coupled spectral basis, and a factorizable ansatz. The former is well-established and serves as a benchmark for the solution of Liouville-von Neumann equation. In the latter, a contracted grid basis of potential-optimized discrete variable representation is tailored to incorporate most of the inter-mode coupling, while the Lindblad operators are represented as tensor products of one-dimensional operators, for consistency. This procedure results in a marked reduction of the grid size and in a much more advantageous scaling of the computational cost with respect to the increase of the dimensionality of the system. The factorizable method is found to provide an accurate description of the dissipative quantum dynamics of the model system, specifically of the time evolution of the state populations and of the probability density distribution of the molecular wave packet. The influence of intra-molecular vibrational energy redistribution appears to be properly taken into account by the new model on the whole range of coupling strengths. It
Structural Dynamics of the Potassium Channel Blocker ShK: SRLS Analysis of (15)N Relaxation.
Meirovitch, Eva; Tchaicheeyan, Oren; Sher, Inbal; Norton, Raymond S; Chill, Jordan H
2015-12-10
The 35-residue ShK peptide binds with high affinity to voltage-gated potassium channels. The dynamics of the binding surface was studied recently with (microsecond to millisecond) (15)N relaxation dispersion and (picosecond to nanosecond) (15)N spin relaxation of the N-H bonds. Relaxation dispersion revealed microsecond conformational-exchange-mediated exposure of the functionally important Y23 side chain to the peptide surface. The spin relaxation parameters acquired at 14.1 and 16.45 T have been subjected to model-free (MF) analysis, which yielded a squared generalized order parameter, S(2), of approximately 0.85 for virtually all of the N-H bonds. Only a "rigid backbone" evaluation could be inferred. We ascribe this limited information to the simplicity of MF in the context of challenging data. To improve the analysis, we apply the slowly relaxing local structure (SRLS) approach, which is a generalization of MF. SRLS describes N-H bond dynamics in ShK in terms of a local potential, u, ranging from 10 to 18.5 kBT, and a local diffusion rate, D2, ranging from 4.2 × 10(8) to 2.4 × 10(10) s(-1). This analysis shows that u is outstandingly strong for Y23 and relatively weak for K22, whereas D2 is slow for Y23 and fast for K22. These observations are relevant functionally because of the key role of the K22-Y23 dyad in ShK binding to potassium channels. The disulfide-bond network exhibits a medium-strength potential and an alternating wave-like D2 pattern. This is indicative of moderate structural restraints and motional plasticity, in support of, although not directly correlated with, the microsecond binding-related conformational exchange process detected previously. Thus, new information on functionally important residues in ShK and its overall conformational stability emerged from the SRLS analysis, as compared with the previous MF-based estimate of backbone dynamics as backbone rigidity.
Uranga-Piña, L; Tremblay, J C
2014-08-21
We investigate the effect of inter-mode coupling on the vibrational relaxation dynamics of molecules in weak dissipative environments. The simulations are performed within the reduced density matrix formalism in the Markovian regime, assuming a Lindblad form for the system-bath interaction. The prototypical two-dimensional model system representing two CO molecules approaching a Cu(100) surface is adapted from an ab initio potential, while the diatom-diatom vibrational coupling strength is systematically varied. In the weak system-bath coupling limit and at low temperatures, only first order non-adiabatic uni-modal coupling terms contribute to surface-mediated vibrational relaxation. Since dissipative dynamics is non-unitary, the choice of representation will affect the evolution of the reduced density matrix. Two alternative representations for computing the relaxation rates and the associated operators are thus compared: the fully coupled spectral basis, and a factorizable ansatz. The former is well-established and serves as a benchmark for the solution of Liouville-von Neumann equation. In the latter, a contracted grid basis of potential-optimized discrete variable representation is tailored to incorporate most of the inter-mode coupling, while the Lindblad operators are represented as tensor products of one-dimensional operators, for consistency. This procedure results in a marked reduction of the grid size and in a much more advantageous scaling of the computational cost with respect to the increase of the dimensionality of the system. The factorizable method is found to provide an accurate description of the dissipative quantum dynamics of the model system, specifically of the time evolution of the state populations and of the probability density distribution of the molecular wave packet. The influence of intra-molecular vibrational energy redistribution appears to be properly taken into account by the new model on the whole range of coupling strengths. It
Relaxation dynamics and thermodynamic properties of glassy Tb0.5Sr0.5MnO3 single crystal
Nhalil, Hariharan; Elizabeth, Suja
2017-03-01
Single crystals of Tb0.5Sr0.5MnO3 were grown in an optical float zone furnace and their magnetic and thermodynamic properties were studied. Temperature dependent DC magnetization measurements at different fields show strong irreversibility below the magnetic anomaly at 44 K. The upward deviation from ideal CW behavior well above the transition temperature and its field independent nature are signatures of non-Griffiths phase. The origin non-Griffiths phase owe to competition between the antiferromagnetic and ferromagnetic Mn3+-Mn4+ interactions mediated through intervening oxygen. Further, 44 K transition is confirmed as a magnetic glassy transition. The estimated dynamical spin flip time (τ0=2.11(3)×10-14 s) and zν(9.3(2)) values fall into the range of typical spin-glass systems. Detailed memory and temperature cycling relaxation measurements were performed and support the Hierarchical relaxation model. Low-temperature specific heat data displays a linear term, identifying the glassy magnetic phase contribution.
Schavkan, Alexander
2017-05-15
This thesis investigates structural properties and the underlying microscopic dynamics of suspensions of α-FeOOH goethite platelets in water under the influence of magnetic fields. Goethite particles show unusual physical properties and a rich phase diagram, which makes their suspensions an object of high interest for research in the area of ''smart nanoparticles''. Five nanoparticle concentrations were chosen such that different liquid crystal phases could be studied. The suspensions of platelets of these chosen concentrations were exposed to magnetic fields of varying strength. Small angle X-ray scattering and X-ray photon correlation spectroscopy data were taken and evaluated. The appearing phases and phase transitions were studied as a function of concentration and applied magnetic field. For this purpose, order parameters, ellipticity, radial and azimuthal peak positions and widths of scattering features were investigated to clarify the structural properties in detail. For the analysis of the underlying dynamics, the relaxation rates and the shape of measured time correlation functions were evaluated. The results show that with increasing magnetic field a partial realignment of the platelets occurs. This realignment is connected to the magnetic properties of the particles. The dynamics of the corresponding phases revealed a dependence on the concentration of nanoparticles in the suspension. At a concentration of c=20 vol% the transition from the nematic to the anti-nematic phase traverses a mixed state. The nematic and anti-nematic phases show ballistic motion and very similar properties, even though a realignment of the particles from an orientation with the long axis parallel to the applied magnetic field in the nematic phase to an orientation with the long axis perpendicular to the magnetic field in the anti-nematic phase occurs. The mixed state of 20 vol%-suspension exhibits a diffusive motion of the particles and different
Werner, Julia; Rams, Michał; Tomkowicz, Zbigniew; Runčevski, Tomče; Dinnebier, Robert E; Suckert, Stefan; Näther, Christian
2015-03-16
Reaction of cobalt thiocyanate with 4-acetylpyridine leads to the formation of [Co(NCS)2(4-acetylpyridine)2]n (3/I). In its crystal structure the Co cations are connected by pairs of μ-1,3-bridging thiocyanato ligands into dimers that are further connected into layers by single anionic ligands. DTA-TG measurements of Co(NCS)2(4-acetyl-pyridine)4 (1) led to the formation of 3/I. In contrast, when the hydrate Co(NCS)2(4-acetyl-pyridine)2(H2O)2 (2) is decomposed, a mixture of 3/I and a thermodynamically metastable form 3/II is obtained. Further investigations reveal that thermal annealing of 2 leads to the formation of 3/II, that contains only traces of the stable form 3/I. DSC and temperature dependent X-ray powder diffraction (XRPD) measurements prove that 3/II transforms into 3/I on heating. The crystal structure of 3/II was determined ab initio from XRPD data. In its crystal structure the Co cations are linked by pairs of bridging thiocyanato anions into a 1D coordination polymer, and thus, 3/II is an isomer of 3/I. Magnetic measurements disclose that the stable form 3/I only shows paramagnetism without any magnetic anomaly down to 2 K. In contrast, the metastable form 3/II shows ferromagnetic behavior. The phase transition into ordered state at Tc = 3.8 K was confirmed by specific heat measurements. Alternating current susceptibility measurements show frequency dependent maxima in χ' and χ″, which is indicative for a slow relaxation of the magnetization.
A functional calculus for the magnetization dynamics
Tranchida, Julien; Nicolis, Stam
2016-01-01
A functional calculus approach is applied to the derivation of evolution equations for the moments of the magnetization dynamics of systems subject to stochastic fields. It allows us to derive a general framework for obtaining the master equation for the stochastic magnetization dynamics, that is applied to both, Markovian and non-Markovian dynamics. The formalism is applied for studying different kinds of interactions, that are of practical relevance and hierarchies of evolution equations for the moments of the distribution of the magnetization are obtained. In each case, assumptions are spelled out, in order to close the hierarchies. These closure assumptions are tested by extensive numerical studies, that probe the validity of Gaussian or non--Gaussian closure Ans\\"atze.
Lin, Po-Heng; Smythe, Nathan C; Gorelsky, Serge I; Maguire, Steven; Henson, Neil J; Korobkov, Ilia; Scott, Brian L; Gordon, John C; Baker, R Tom; Murugesu, Muralee
2011-10-12
Two mononuclear high-spin Fe(II) complexes with trigonal planar ([Fe(II)(N(TMS)(2))(2)(PCy(3))] (1) and distorted tetrahedral ([Fe(II)(N(TMS)(2))(2)(depe)] (2) geometries are reported (TMS = SiMe(3), Cy = cyclohexyl, depe = 1,2-bis(diethylphosphino)ethane). The magnetic properties of 1 and 2 reveal the profound effect of out-of-state spin-orbit coupling (SOC) on slow magnetic relaxation. Complex 1 exhibits slow relaxation of the magnetization under an applied optimal dc field of 600 Oe due to the presence of low-lying electronic excited states that mix with the ground electronic state. This mixing re-introduces orbital angular momentum into the electronic ground state via SOC, and 1 thus behaves as a field-induced single-molecule magnet. In complex 2, the lowest-energy excited states have higher energy due to the ligand field of the distorted tetrahedral geometry. This higher energy gap minimizes out-of-state SOC mixing and zero-field splitting, thus precluding slow relaxation of the magnetization for 2.
Magnetic dynamics of small alpha-Fe2O3 and NiO particles
Lefmann, K.; Bødker, Franz; Hansen, Mikkel Fougt;
1999-01-01
We have studied the magnetic dynamics in nanocrystalline samples of alpha-Fe2O3 (hematite) and NiO by inelastic neutron scattering. By measuring around the structural and the antiferromagnetic reflections, we have probed uniform and staggered magnetic oscillations, respectively. In the hematite...... as a sign of superparamagnetic relaxation. Studies of the antiferromagnetic signal from NiO also show evidence of collective magnetic excitations, but with a higher energy of the precession state than for hematite. The inelastic signal at the structural reflection of NiO presents evidence for uniform...
Dynamics of a chain of magnetic particles connected with elastic linkers
Cebers, A
2003-01-01
The model of an elastic magnetic chain is considered. By numerical simulation of the dynamics of rod shapes acted on by magnetic and elastic forces in viscous fluid, it is shown that the characteristic 'U'-like metastable shapes (hairpins) can be formed. The characteristic 'S'-like long-living shapes are formed at intermediate stages, depending on the initial perturbation of the rod, and finally relax to the global energy minima corresponding to the straight rod. Further extensions of the model will include long-range magnetic interactions between distant parts of a rod.
Gao, Hong-Ling; Jiang, Li; Liu, Shuang; Shen, Hai-Yun; Wang, Wen-Min; Cui, Jian-Zhong
2016-01-07
Seven new tetranuclear rare earth (RE) complexes [RE4(acac)4L6(μ3-OH)2] (HL = 5-(4-fluorobenzylidene)-8-hydroxylquinoline; acac = acetylacetonate; RE = Y (1), Eu (2), Gd (3), Tb (4), Dy (5), Tm (6) and Lu (7)) have been synthesized and completely characterized. Complex exhibits multiple zero-field slow magnetic relaxation processes typical of Single Molecule Magnets (SMMs). Two distinct slow magnetic relaxation processes, with effective energy barriers of Ueff = 48 K for the slow relaxation (SR) process and Ueff = 121 K for the fast relaxation (FR) process, are mainly attributed to the presence of two crystallographically independent Dy(III) sites. The magnetocaloric effect (MCE) was detected as -ΔSm(T) = 20.8 J kg(-1) K(-1) for complex . The fluorescence properties of complexes 1, 2, 4, 5 and 7 were also investigated. Complexes 2, 4 and 5 show the characteristic peaks for their corresponding RE(III) center, while complexes 1 and 7 show similar emission peaks to the Schiff base ligand when they are excited at the appropriate wavelength.
Electronic relaxation dynamics of PCDA-PDA studied by transient absorption spectroscopy.
Joung, Joonyoung F; Baek, Junwoo; Kim, Youngseo; Lee, Songyi; Kim, Myung Hwa; Yoon, Juyoung; Park, Sungnam
2016-08-17
Photo-curable polymers originating from 10,12-pentacosadiynoic acid (PCDA-PDA) are commonly used polydiacetylenes (PDAs). PCDA-PDA exhibits thermochromic properties undergoing a unique colorimetric transition from blue to red as the temperature is increased from low to high. In this work, we have carefully studied the temperature-dependent optical properties of PCDA-PDA by using UV-visible absorption, FTIR, Raman, and transient absorption (TA) spectroscopy in combination with quantum chemical calculations. Temperature-dependent UV-visible absorption spectra indicate that PCDA-PDA exhibits reversible thermochromic properties up to 60 °C and its thermochromic properties become irreversible above 60 °C. Such distinct thermochromic properties are also manifested in TA signals so that the electronically excited PCDA-PDA relaxes to the ground state via an intermediate state at 20 °C (blue form) but it relaxes directly back to the ground state at 80 °C (red form). The electronic relaxation dynamics of PCDA-PDA are comprehensively analyzed based on different kinetic models by using the global fitting analysis method. The intermediate state in the blue form of PCDA-PDA is clearly found to be responsible for fluorescence quenching. FTIR and Raman spectroscopy and quantum chemical calculations confirm that the H-bonds between the carboxylic acid groups in PCDA-PDA are broken at high temperatures leading to an irreversible structural change of PCDA-PDA.
Histidine side-chain dynamics and protonation monitored by {sup 13}C CPMG NMR relaxation dispersion
Hass, Mathias A. S. [Leiden University, Institute of Chemistry (Netherlands); Yilmaz, Ali [University of Copenhagen, Department of Medicinal Chemistry, Faculty of Pharmaceutical Sciences (Denmark); Christensen, Hans E. M. [Technical University of Denmark, Department of Chemistry (Denmark); Led, Jens J. [University of Copenhagen, Department of Chemistry (Denmark)], E-mail: led@kiku.dk
2009-08-15
The use of {sup 13}C NMR relaxation dispersion experiments to monitor micro-millisecond fluctuations in the protonation states of histidine residues in proteins is investigated. To illustrate the approach, measurements on three specifically {sup 13}C labeled histidine residues in plastocyanin (PCu) from Anabaena variabilis (A.v.) are presented. Significant Carr-Purcell-Meiboom-Gill (CPMG) relaxation dispersion is observed for {sup 13}C{sup {epsilon}}{sup 1} nuclei in the histidine imidazole rings of A.v. PCu. The chemical shift changes obtained from the CPMG dispersion data are in good agreement with those obtained from the chemical shift titration experiments, and the CPMG derived exchange rates agree with those obtained previously from {sup 15}N backbone relaxation measurements. Compared to measurements of backbone nuclei, {sup 13}C{sup {epsilon}}{sup 1} dispersion provides a more direct method to monitor interchanging protonation states or other kinds of conformational changes of histidine side chains or their environment. Advantages and shortcomings of using the {sup 13}C{sup {epsilon}}{sup 1} dispersion experiments in combination with chemical shift titration experiments to obtain information on exchange dynamics of the histidine side chains are discussed.
Grain Boundary Relaxation in Bi-Crystals: Mechanical Spectroscopy and Molecular Dynamics Simulations
Maier A.-K.
2015-04-01
Full Text Available Different Au-Ag-Cu samples have been studied by mechanical spectroscopy. Both polycrystals and bi-crystals show a relaxation peak at 800 K, accompanied by an elastic modulus change. Since this peak is absent in single crystals it is related to the presence of grain boundaries. Molecular dynamics simulations reveal two microscopic mechanisms, when a shear stress is applied onto a Σ5 grain boundary: at 700 K, the boundary migrates perpendicularly to the boundary plane under an external stress. At 1000 K, only sliding at the boundary is observed. These two mechanisms acting in different temperature intervals are used to model the mechanic response of a polycrystal under an applied stress. The models yield expressions for the relaxation strength Δ and for the relaxation time τ as a function of the grain size. A comparison with the mechanical spectroscopy measurements of polycrystals and the bi-crystals show that the grain boundary sliding model reproduces correctly the characteristics of the grain boundary peak.
Metal Atom Dynamics and Spin-Lattice Relaxation in Multilayer Sandwich Compounds
Nowik, Israel; Herber, Rolfe H., E-mail: HERBER@VMS.HUJI.AC.il [Hebrew University of Jerusalem, Racah Institute of Physics (Israel)
2004-12-15
Temperature-dependent {sup 57}Fe Moessbauer spectroscopy has been used to elucidate the hyperfine parameters and dynamical behavior of the metal atom in several organo-iron complexes which have one or more {eta}{sup 5} P{sub 5} ring structures as ligated groups. The spin-lattice relaxation of the (paramagnetic) one-electron oxidation products occurs on a time scale fast compared to {tau}{sub 1/2} (ME) at temperatures in the range 85 < T < 320 K.
Davies, H. C.; Turner, R. E.
1977-01-01
A dynamical relaxation technique for updating prediction models is analyzed with the help of the linear and nonlinear barotropic primitive equations. It is assumed that a complete four-dimensional time history of some prescribed subset of the meteorological variables is known. The rate of adaptation of the flow variables toward the true state is determined for a linearized f-model, and for mid-latitude and equatorial beta-plane models. The results of the analysis are corroborated by numerical experiments with the nonlinear shallow-water equations.
Magnetism From Fundamentals to Nanoscale Dynamics
Stöhr, Joachim
2006-01-01
The present text book gives an comprehensive account of magnetism, spanning the historical development, the physical foundations and the continuing research underlying the field, one of the oldest yet still vibrant field of physics. It covers both the classical and quantum mechanical aspects of magnetism and novel experimental techniques. Perhaps uniquely, it also discusses spin transport and magnetization dynamics phenomena associated with atomically and spin engineered nano-structures against the backdrop of spintronics and magnetic storage and memory applications. Despite the existence of various books on the topic, a fresh text book that reviews the fundamental physical concepts and uses them in a coherent fashion to explain some of the forefront problems and applications today was thought useful by the authors and their colleagues. Magnetism is written for students on the late undergraduate and the graduate levels and should also serve as a state-of-the-art reference for scientists in academia and resear...
Baranowski, M.; Woźniak-Braszak, A.; Jurga, K.
2016-01-01
The paper presents the benefits of using fast adiabatic passage for the study of molecular dynamics in the solid state heteronuclear systems in the laboratory frame. A homemade pulse spectrometer operating at the frequency of 30.2 MHz and 28.411 MHz for protons and fluorines, respectively, has been enhanced with microcontroller direct digital synthesizer DDS controller [1-4]. This work briefly describes how to construct a low-cost and easy-to-assemble adiabatic extension set for homemade and commercial spectrometers based on recently very popular Arduino shields. The described set was designed for fast adiabatic generation. Timing and synchronization problems are discussed. The cross-relaxation experiments with different initial states of the two spin systems have been performed. Contrary to our previous work [5] where the steady-state NOE experiments were conducted now proton spins 1H are polarized in the magnetic field B0 while fluorine spins 19F are perturbed by selective saturation for a short time and then the system is allowed to evolve for a period in the absence of a saturating field. The adiabatic passage application leads to a reversal of magnetization of fluorine spins and increases the amplitude of the signal.
Alexandrov, Nikola A; Marinova, Krastanka G; Gurkov, Theodor D; Danov, Krassimir D; Kralchevsky, Peter A; Stoyanov, Simeon D; Blijdenstein, Theodorus B J; Arnaudov, Luben N; Pelan, Eddie G; Lips, Alex
2012-06-15
The pendant-drop method (with drop-shape analysis) and Langmuir trough are applied to investigate the characteristic relaxation times and elasticity of interfacial layers from the protein HFBII hydrophobin. Such layers undergo a transition from fluid to elastic solid films. The transition is detected as an increase in the error of the fit of the pendant-drop profile by means of the Laplace equation of capillarity. The relaxation of surface tension after interfacial expansion follows an exponential-decay law, which indicates adsorption kinetics under barrier control. The experimental data for the relaxation time suggest that the adsorption rate is determined by the balance of two opposing factors: (i) the barrier to detachment of protein molecules from bulk aggregates and (ii) the attraction of the detached molecules by the adsorption layer due to the hydrophobic surface force. The hydrophobic attraction can explain why a greater surface coverage leads to a faster adsorption. The relaxation of surface tension after interfacial compression follows a different, square-root law. Such behavior can be attributed to surface diffusion of adsorbed protein molecules that are condensing at the periphery of interfacial protein aggregates. The surface dilatational elasticity, E, is determined in experiments on quick expansion or compression of the interfacial protein layers. At lower surface pressures (<11 mN/m) the experiments on expansion, compression and oscillations give close values of E that are increasing with the rise of surface pressure. At higher surface pressures, E exhibits the opposite tendency and the data are scattered. The latter behavior can be explained with a two-dimensional condensation of adsorbed protein molecules at the higher surface pressures. The results could be important for the understanding and control of dynamic processes in foams and emulsions stabilized by hydrophobins, as well as for the modification of solid surfaces by adsorption of such
Feng, Xiaowen; Liu, Junjie; Harris, T David; Hill, Stephen; Long, Jeffrey R
2012-05-02
The model compounds (NBu(4))(2)[ReCl(4)(CN)(2)] (1), (DMF)(4)ZnReCl(4)(CN)(2) (2), and [(PY5Me(2))(2)Mn(2)ReCl(4)(CN)(2)](PF(6))(2) (3) have been synthesized to probe the origin of the magnetic anisotropy barrier in the one-dimensional coordination solid (DMF)(4)MnReCl(4)(CN)(2) (4). High-field electron paramagnetic resonance spectroscopy reveals the presence of an easy-plane anisotropy (D > 0) with a significant transverse component, E, in compounds 1-3. These findings indicate that the onset of one-dimensional spin correlations within the chain compound 4 leads to a suppression of quantum tunneling of the magnetization within the easy plane, resulting in magnetic bistability and slow relaxation behavior. Within this picture, it is the transverse E term associated with the Re(IV) centers that determines the easy axis and the anisotropy energy scale associated with the relaxation barrier. The results demonstrate for the first time that slow magnetic relaxation can be achieved through optimization of the transverse anisotropy associated with magnetic ions that possess easy-plane anisotropy, thus providing a new direction in the design of single-molecule and single-chain magnets.
Enemark, Søren; Santos, Ilmar
2014-01-01
Passive magnetic bearings are known due to the excellent characteristics in terms of friction and no requirement of additional energy sources to work. However, passive magnetic bearings do not provide damping, are not stable and, depending on their design, may also introduce magnetic eccentricity....... Such magnetic eccentricities are generated by discrepancies in magnet fabrication. In this framework the main focus of the work is the theoretical as well as experimental investigation of the nonlinear dynamics of a rotor-bearing system with strong emphasis on the magnetic eccentricities and non......-linear stiffness. In this investigation passive magnetic bearings using axially- aligned neodymium cylinder magnets are investigated. The cylinder magnets are axially magnetised for rotor as well as bearings. Compared to bearings with radial magnetisation, the magnetic stiffness of axially-aligned bearings...
Adelnia, Fatemeh; Lascialfari, Alessandro [Dipartimento di Fisica, Università degli Studi di Milano and INSTM, Milano (Italy); Dipartimento di Fisica, Università degli Studi di Pavia and INSTM, Pavia (Italy); Mariani, Manuel [Dipartimento di Fisica e Astronomia, Università di Bologna, Bologna (Italy); Ammannato, Luca; Caneschi, Andrea; Rovai, Donella [Dipartimento di Chimica, Università degli Studi di Firenze and INSTM, Firenze (Italy); Winpenny, Richard; Timco, Grigore [School of Chemistry, The University of Manchester, Manchester (United Kingdom); Corti, Maurizio, E-mail: maurizio.corti@unipv.it; Borsa, Ferdinando [Dipartimento di Fisica, Università degli Studi di Pavia and INSTM, Pavia (Italy)
2015-05-07
We present the room temperature proton nuclear magnetic resonance (NMR) nuclear spin-lattice relaxation rate (NSLR) results in two 1D spin chains: the Heisenberg antiferromagnetic (AFM) Eu(hfac){sub 3}NITEt and the magnetically frustrated Gd(hfac){sub 3}NITEt. The NSLR as a function of external magnetic field can be interpreted very well in terms of high temperature spin dynamics dominated by a long time persistence of the decay of the two-spin correlation function due to the conservation of the total spin value for isotropic Heisenberg chains. The high temperature spin dynamics are also investigated in Heisenberg AFM molecular rings. In both Cr{sub 8} closed ring and in Cr{sub 7}Cd and Cr{sub 8}Zn open rings, i.e., model systems for a finite spin segment, an enhancement of the low frequency spectral density is found consistent with spin diffusion but the high cut-off frequency due to intermolecular anisotropic interactions prevents a detailed analysis of the spin diffusion regime.
Spin-charge coupled dynamics driven by a time-dependent magnetization
Tölle, Sebastian; Eckern, Ulrich; Gorini, Cosimo
2017-03-01
The spin-charge coupled dynamics in a thin, magnetized metallic system are investigated. The effective driving force acting on the charge carriers is generated by a dynamical magnetic texture, which can be induced, e.g., by a magnetic material in contact with a normal-metal system. We consider a general inversion-asymmetric substrate/normal-metal/magnet structure, which, by specifying the precise nature of each layer, can mimic various experimentally employed setups. Inversion symmetry breaking gives rise to an effective Rashba spin-orbit interaction. We derive general spin-charge kinetic equations which show that such spin-orbit interaction, together with anisotropic Elliott-Yafet spin relaxation, yields significant corrections to the magnetization-induced dynamics. In particular, we present a consistent treatment of the spin density and spin current contributions to the equations of motion, inter alia, identifying a term in the effective force which appears due to a spin current polarized parallel to the magnetization. This "inverse-spin-filter" contribution depends markedly on the parameter which describes the anisotropy in spin relaxation. To further highlight the physical meaning of the different contributions, the spin-pumping configuration of typical experimental setups is analyzed in detail. In the two-dimensional limit the buildup of dc voltage is dominated by the spin-galvanic (inverse Edelstein) effect. A measuring scheme that could isolate this contribution is discussed.
Ling, Wen; Jerschow, Alexej
2007-02-14
Of the various ways in which nuclear spin systems can relax to their ground states, the processes involving an interference between different relaxation mechanisms, such as dipole-dipole coupling and chemical shift anisotropy, have become of great interest lately. The authors show here that the interference between the quadrupolar coupling and the paramagnetic interaction (cross-correlated relaxation) gives rise to nuclear spin transitions that would remain forbidden otherwise. In addition, frequency shifts arise. These would be reminiscent of residual anisotropic interactions when there are none. While interesting from a fundamental point of view, these processes may become relevant in magnetic resonance imaging experiments which involve quadrupolar spins, such as (23)Na, in the presence of contrast agents. Geometrical constraints in paramagnetic molecule structures may likewise be derived from these interference effects.
Yemloul, Mehdi; Steiner, Emilie; Robert, Anthony; Bouguet-Bonnet, Sabine; Allix, Florent; Jamart-Grégoire, Brigitte; Canet, Daniel
2011-03-24
An organogelation process depends on the gelator-solvent pair. This study deals with the solvent dynamics once the gelation process is completed. The first approach used is relaxometry, i.e., the measurement of toluene proton longitudinal relaxation time T(1) as a function of the proton NMR resonance frequency (here in the 5 kHz to 400 MHz range). Pure toluene exhibits an unexpected T(1) variation, which has been identified as paramagnetic relaxation resulting from an interaction of toluene with dissolved oxygen. In the gel phase, this contribution is retrieved with, in addition, a strong decay at low frequencies assigned to toluene molecules within the gel fibers. Comparison of dispersion curves of pure toluene and toluene in the gel phase leads to an estimate of the proportion of toluene embedded within the organogel (found around 40%). The second approach is based on carbon-13 T(1) and nuclear Overhauser effect measurements, the combination of these two parameters providing direct information about the reorientation of C-H bonds. It appears clearly that reorientation of toluene is the same in pure liquid and in the gel phase. The only noticeable changes in carbon-13 longitudinal relaxation times are due to the so-called chemical shift anisotropy (csa) mechanism and reflect slight modifications of the toluene electronic distribution in the gel phase. NMR diffusion measurements by the pulse gradient spin-echo (PGSE) method allow us to determine the diffusion coefficient of toluene inside the organogel. It is roughly two-thirds of the one in pure toluene, thus indicating that self-diffusion is the only dynamical parameter to be slightly affected when the solvent is inside the gel structure. The whole set of experimental observations leads to the conclusion that, once the gel is formed, the solvent becomes essentially passive, although an important fraction is located within the gel structure.
Effects of diffusion in magnetically inhomogeneous media on rotating frame spin-lattice relaxation
Spear, John T.; Gore, John C.
2014-12-01
In an aqueous medium containing magnetic inhomogeneities, diffusion amongst the intrinsic susceptibility gradients contributes to the relaxation rate R1ρ of water protons to a degree that depends on the magnitude of the local field variations ΔBz, the geometry of the perturbers inducing these fields, and the rate of diffusion of water, D. This contribution can be reduced by using stronger locking fields, leading to a dispersion in R1ρ that can be analyzed to derive quantitative characteristics of the material. A theoretical expression was recently derived to describe these effects for the case of sinusoidal local field variations of a well-defined spatial frequency q. To evaluate the degree to which this dispersion may be extended to more realistic field patterns, finite difference Bloch-McConnell simulations were performed with a variety of three-dimensional structures to reveal how simple geometries affect the dispersion of spin-locking measurements. Dispersions were fit to the recently derived expression to obtain an estimate of the correlation time of the field variations experienced by the spins, and from this the mean squared gradient and an effective spatial frequency were obtained to describe the fields. This effective spatial frequency was shown to vary directly with the second moment of the spatial frequency power spectrum of the ΔBz field, which is a measure of the average spatial dimension of the field variations. These results suggest the theory may be more generally applied to more complex media to derive useful descriptors of the nature of field inhomogeneities. The simulation results also confirm that such diffusion effects disperse over a range of locking fields of lower amplitude than typical chemical exchange effects, and should be detectable in a variety of magnetically inhomogeneous media including regions of dense microvasculature within biological tissues.
Mance, Deni; Baldus, Marc, E-mail: m.baldus@uu.nl [NMR Spectroscopy, Bijvoet Center for Biomolecular Research, Department of Chemistry, Faculty of Science, Utrecht University, 3584 CH Utrecht (Netherlands); Gast, Peter; Huber, Martina [Department of Physics, Huygens-Kamerlingh Onnes Laboratory, Leiden University, PO Box 9504, 2300 RA Leiden (Netherlands); Ivanov, Konstantin L., E-mail: ivanov@tomo.nsc.ru [International Tomography Center, Siberian Branch of the Russian Academy of Science, Institutskaya 3a, Novosibirsk 630090, Russia and Novosibirsk State University, Pirogova 2, Novosibirsk 63009 (Russian Federation)
2015-06-21
We develop a theoretical description of Dynamic Nuclear Polarization (DNP) in solids under Magic Angle Spinning (MAS) to describe the magnetic field dependence of the DNP effect. The treatment is based on an efficient scheme for numerical solution of the Liouville-von Neumann equation, which explicitly takes into account the variation of magnetic interactions during the sample spinning. The dependence of the cross-effect MAS-DNP on various parameters, such as the hyperfine interaction, electron-electron dipolar interaction, microwave field strength, and electron spin relaxation rates, is analyzed. Electron spin relaxation rates are determined by electron paramagnetic resonance measurements, and calculations are compared to experimental data. Our results suggest that the observed nuclear magnetic resonance signal enhancements provided by MAS-DNP can be explained by discriminating between “bulk” and “core” nuclei and by taking into account the slow DNP build-up rate for the bulk nuclei.
Riviere, J. V.; Shokouhi, P.; Marone, C.; Elsworth, D.; Guyer, R. A.; Johnson, P. A.
2015-12-01
We study nonlinear elastic/acoustic phenomena in rocks at the laboratory scale, with the goal of understanding observations at crustal scales, for instance during strong ground motion and earthquake slip processes. In particular, a long-term goal is to relate microstructure of rocks/gouge to nonlinear acoustic properties. A dynamic perturbation with modest (i.e. acoustic) strain amplitude (10-6 Berea sandstone to explore short-term relaxation, down to 10-4s (DAE is the dynamic equivalent of measuring acoustic velocity as a function of applied pressure). We find that early recovery does not follow a logarithmic law, while some earlier studies based on resonance techniques and at times larger than 1s do exhibit log(t)-recovery. From this non-log(t) dataset, we extract a spectrum of relaxation rates and discuss the potential relation between characteristic rates and rock microstructure. We also discuss the possible links between transient elastic softening and transient increase in permeability due to dynamic perturbation.
Yuan, Li; Chen, Lan; Chen, Xiaohong; Liu, Renxiao; Ge, Guanglu
2017-09-05
In situ analysis and study on the surface of nanoparticles (NPs) is a key to obtain their important physicochemical properties for the subsequent applications. Of them, most works focus on the qualitative characterization whereas quantitative analysis and measurement on the NPs under their storage and usage conditions is still a challenge. In order to cope with this challenge, solvation relaxation-based nuclear magnetic resonance (NMR) technology has been applied to measure the wet specific surface area and, therefore, determine the number of the bound water molecules on the surface of silica NPs in solution and the hydrophilic groups of various types grafted on the surface of the NPs. By changing the surface functional group on silica particles, the fine distinction for the solvent-particle interaction with different surface group can be quantitatively differentiated by measuring the number of water molecules absorbed on the surface. The results show that the number of the surface hydroxyl, amine, and carboxyl group per nm(2) is 4.0, 3.7, and 2.3, respectively, for the silica particles with a diameter of 203 nm. The method reported here is the first attempt to determine in situ the number of bound solvent molecules and any solvophilic groups grafted on nanoparticles.
Amjad, Asma; Madalan, Augustin; Andruh, Marius; Caneschi, Andrea; Sorace, Lorenzo; University of Bucharest, Faculty of Chemistry, Inorganic Chemistry Laboratory, Bucharest, Romania Collaboration
2015-03-01
Lanthanide based molecular complexes have shown potential to behave as single molecule magnets proficient to function above cryogenic temperatures. In this work we explore the dynamics of one such family, [Zn(LH)2Ln](NO3)3 .6H2O - (Ln = Nd3+, Dy3+, Tb3+, Ho3+, Er3+, Yb3+) . The series has a single lanthanide ion as a magnetic center in a low symmetry environment; the dynamics and energy landscape of the series is explored using X-band EPR, AC and DC susceptibility over a range of temperature, field and frequency. DC magnetic data show χT value consistent with expected behavior. EPR spectra for Er3+ and Yb3+ complexes shows EPR spectra typical for easy-plane and quasi-isotropic systems respectively, thus explaining the lack of out of phase susceptibility even in an external applied filed. However, Dy3+ derivative show slow relaxation of the magnetization in zero field up to 15 K and is, accordingly EPR silent.
Salloum, Ahmed
Constraint relaxation by definition means that certain security, operational, or financial constraints are allowed to be violated in the energy market model for a predetermined penalty price. System operators utilize this mechanism in an effort to impose a price-cap on shadow prices throughout the market. In addition, constraint relaxations can serve as corrective approximations that help in reducing the occurrence of infeasible or extreme solutions in the day-ahead markets. This work aims to capture the impact constraint relaxations have on system operational security. Moreover, this analysis also provides a better understanding of the correlation between DC market models and AC real-time systems and analyzes how relaxations in market models propagate to real-time systems. This information can be used not only to assess the criticality of constraint relaxations, but also as a basis for determining penalty prices more accurately. Constraint relaxations practice was replicated in this work using a test case and a real-life large-scale system, while capturing both energy market aspects and AC real-time system performance. System performance investigation included static and dynamic security analysis for base-case and post-contingency operating conditions. PJM peak hour loads were dynamically modeled in order to capture delayed voltage recovery and sustained depressed voltage profiles as a result of reactive power deficiency caused by constraint relaxations. Moreover, impacts of constraint relaxations on operational system security were investigated when risk based penalty prices are used. Transmission lines in the PJM system were categorized according to their risk index and each category was as-signed a different penalty price accordingly in order to avoid real-time overloads on high risk lines. This work also extends the investigation of constraint relaxations to post-contingency relaxations, where emergency limits are allowed to be relaxed in energy market models
Electron spin coherence and effect of spin polarization on electron relaxation dynamics in GaAs
Teng, Lihua; Wang, Xia; Ge, Weikun; Lai, Tianshu
2011-09-01
Time-resolved circularly and linearly polarized pump-probe spectroscopy is used to study the evolution of the electron spin coherence and electron relaxation dynamics in bulk GaAs at 9.6 K. In particular, their dependence on photon energy (or electron excess energy) is carefully investigated. The absorption quantum beats which are observed in circularly polarized pump-probe spectroscopy are obtained, reflecting the dephasing of the electron spin coherence. A circularly dichromatic pump-probe model is developed with both the spin-polarization-dependent band-filling and band-gap renormalization effects being taken into account. The model is used to simulate the differential transmission spectra for the collinearly polarized, co-helicity circularly polarized and cross-helicity circularly polarized pump-probe configurations, respectively. It is found that the model simulates well the features of the absorption quantum beats for a spin-dependent thermalized distribution of the photocreated carriers by a circularly polarized pump pulse, such as the variation of the oscillatory amplitude and phase reversal of the absorption quantum beats with photon energy increase. The simulation is in good agreement with our experimental results and reveals the effect of spin polarization on electron relaxation dynamics.
Femtosecond spectroscopy study of the exciton relaxation dynamics in silicon quantum dots
Kryschi, Carola; Kuntermann, Volker; Cimpean, Carla [Institut fuer Physikalische Chemie I, FAU, Erlangen (Germany); Haarer, Dietrich [BIMF, Universitaet Bayreuth (Germany)
2008-07-01
This contribution is targeted to the development of surface-modified silicon quantum dots (Siqdots) with tailored luminescence properties. The surface modification of Siqdots with sizes between 1 and 5 nm has been successfully achieved via two different synthesis routes, first, by controlled oxidation followed from silanization and second, by thermal hydrosilylation with chromophores. The luminescence properties of ethanolic Siqdots dispersions were characterized using stationary and time-resolved luminescence spectroscopy techniques, whereas the ultrashort exciton relaxation dynamics were examined using femtosecond transient absorption spectroscopy. Silanized Siqdots were observed to exhibit two species of photoluminescence (PL): the blue emission at 380 nm is assigned to localized surface states, whereas radiative recombination of quantum confined excitons gives rise to a broad PL band around 800 nm. Whereas the latter is ascribed to Siqdots with sizes larger than 3 nm, for Siqdots smaller than 1.5 nm exciton relaxation dynamics is understood to occur predominantly by trapping due to lower-lying surface states which may radiatively decay. Siqdots terminated with suited chromophores were observed to exhibit only one PL band in the visible that is ascribed to exciton states involving resonant couplings to the conjugated electron system of the chromophores.
Barrientos, Eva; Pelayo, Fernández; Tanaka, Eiji; Lamela-Rey, María Jesús; Fernández-Canteli, Alfonso
2016-04-01
In this study, the dynamic and static compressive properties of the whole porcine temporomandibular joint (TMJ) disc were investigated. The aim of the study was to develop a new simple method for the evaluation of joint viscoelasticity, enabling examination of the load-bearing capacity and joint flexibility of the entire disc. For the experiments, a novel testing fixture that reproduces the condylar and fossa surfaces of the TMJ was developed to replicate TMJ disc geometry. Ten porcine discs were used in the experiments. Each disc was dissected from the TMJ and sinusoidal compressive strain was applied to obtain the storage and loss moduli. Static strain control tests were carried out to obtain the relaxation modulus. The result of static and dynamic tests indicated that the whole disc presented viscoelastic behavior under compression. Storage and loss moduli increased with frequency and the relaxation modulus decreased over time. The loss tangent showed less frequency dependence, with values ranging from 0.2 to 0.3, suggesting that the viscous properties of the disc cannot be neglected. These results provide a better understanding of whole disc mechanical compression behavior under realistic TMJ working conditions.
Active site dynamics in NADH oxidase from Thermus thermophilus studied by NMR spin relaxation.
Miletti, Teresa; Farber, Patrick J; Mittermaier, Anthony
2011-09-01
We have characterized the backbone dynamics of NADH oxidase from Thermus thermophilus (NOX) using a recently-developed suite of NMR experiments designed to isolate exchange broadening, together with (15)N R (1), R (1ρ ), and {(1)H}-(15)N steady-state NOE relaxation measurements performed at 11.7 and 18.8 T. NOX is a 54 kDa homodimeric enzyme that belongs to a family of structurally homologous flavin reductases and nitroreductases with many potential biotechnology applications. Prior studies have suggested that flexibility is involved in the catalytic mechanism of the enzyme. The active site residue W47 was previously identified as being particularly important, as its level of solvent exposure correlates with enzyme activity, and it was observed to undergo "gating" motions in computer simulations. The NMR data are consistent with these findings. Signals from W47 are dynamically broadened beyond detection and several other residues in the active site have significant R ( ex ) contributions to transverse relaxation rates. In addition, the backbone of S193, whose side chain hydroxyl proton hydrogen bonds directly with the FMN cofactor, exhibits extensive mobility on the ns-ps timescale. We hypothesize that these motions may facilitate structural rearrangements of the active site that allow NOX to accept both FMN and FAD as cofactors.
Zhang, Longcai; Wang, Suyu; Wang, Jiasu; Zheng, Jun
2007-12-01
Superconducting maglev vehicle is one of the most promising applications of HTS bulks. In such a system, the HTS bulks are always exposed to time-varying external magnetic field, which is generated by the inhomogeneous surface magnetic field of the NdFeB guideway. So it is required to study whether the guidance force of the bulks is influenced by the inhomogeneity. In this paper, we studied the characteristics of the guidance force relaxation between the HTS bulk and the NdFeB guideway by an experiment in which AC external magnetic field generated by an electromagnet was used to simulate the time-varying external magnetic field caused by the inhomogeneity of the guideway. From the experiment results, it was found that the guidance force was decreased with the application of the AC external magnetic field, and the decay increased with the amplitude and was almost independent of the frequency.
Anisotropic relaxation dynamics in a dipolar Fermi gas driven out of equilibrium
Aikawa, K.; Frisch, A.; Mark, M.;
2014-01-01
We report on the observation of a large anisotropy in the rethermalization dynamics of an ultracold dipolar Fermi gas driven out of equilibrium. Our system consists of an ultracold sample of strongly magnetic $^{167}$Er fermions, spin-polarized in the lowest Zeeman sublevel. In this system, elastic...
Obeada, Cecilia N.; Malaescu, I., E-mail: malaescu@physics.uvt.ro
2013-09-01
In the present paper the temperature effect on the interplay of Brownian and Néel relaxation processes, in a water-based magnetic fluid with mixed magnetite and tetragonal maghemite particles was analyzed. In consequence, the frequency (f=ω/2π) and temperature (T) dependencies of the complex magnetic permeability, μ(f,T)=μ′(f,T)−iμ''(f,T), over the frequency range 3 kHz–2 MHz and at various values of temperatures within the range (25–90) °C were measured. The imaginary component of the complex magnetic permeability μ''(f,T) shows two maxima: the first maximum is a large one, in the frequency range (10–40) kHz, being present only at temperatures below 60 °C and the second maximum, around the frequency of 1 MHz, is present at all temperatures at which measurements were made. The first maximum is assigned to the Brownian relaxation process of particle agglomerations within the sample, which have the hydrodynamic diameter in order of (30–33) nm. The second maximum of μ''(f,T) component is assigned to the Néel relaxation process of tetragonal maghemite particles. The results are intended to clarify some fundamental issues concerning the magnetic properties of magnetic fluids in low-frequency field and can be used to study particle agglomeration processes in magnetic fluids, but also for biomedical applications such as cancer treatment by magnetic hyperthermia of tissues.
Mito, Masaki; Matsui, Hideaki; Tsuruta, Kazuki; Deguchi, Hiroyuki; Kishine, Jun-ichiro; Inoue, Katsuya; Kousaka, Yusuke; Yano, Shin-ichiro; Nakao, Yuya; Akimitsu, Jun
2015-10-01
The nonlinear and linear magnetic responses to an ac magnetic field H are useful for the study of the magnetic dynamics of both magnetic domains and their constituent spins. In particular, the third-harmonic magnetic response M3ω reflects the dynamics of magnetic domains. Furthermore, by considering the ac magnetic response as a function of H, we can evaluate the degree of magnetic nonlinearity, which is closely related to M3ω. In this study, a series of approaches was used to examine the itinerant magnet MnP, in which both ferromagnetic and helical phases are present. On the basis of this investigation, we systematize the diagnostic approach to evaluating nonlinearity in magnetic responses.
Spin Dynamics simulations of the dynamic properties of classical models for magnetic materials
Bunker, Alex; Landau, D. P.
1998-03-01
The Spin Dynamics simulation technique, which has had considerable success for the study of critical properties of classical Heisenberg antiferromagnets(A. Bunker, K. Chen, and D. P. Landau Phys. Rev. B) \\underline54, 9259 (1996), has been used to determine more general properties for a wider range of materials. A general spin dynamics program has been developed which can determine the dynamic structure factor, S(q,ω), in the [100], [110], and [111] directions for a wide range of classical magnetic models at any temperature desired. We have simulated the magnetic dynamics in the ordered phase of the isotropic Heisenberg model with both ferromagnetic and antiferromagnetic coupling on L×L×L BCC and SC lattices. Outside of the critical regime relatively small lattice sizes of L = 12, 24 could be used. From our simulation we have determined the stiffness coefficient and the spin relaxation rate which were compared to both experimental(J. Als-Nielsen in Phase Transitions and Critical Phenomena), ed. C. Domb, M. S. Green, Academic Press, (1976) and theoretical results. We have performed the same simulation with anisotropy appropriate for MnF2 and FeF_2. Research supported in part by the NSF
Lamley, Jonathan M; Lougher, Matthew J; Sass, Hans Juergen; Rogowski, Marco; Grzesiek, Stephan; Lewandowski, Józef R
2015-09-14
Typically, protein dynamics involve a complex hierarchy of motions occurring on different time scales between conformations separated by a range of different energy barriers. NMR relaxation can in principle provide a site-specific picture of both the time scales and amplitudes of these motions, but independent relaxation rates sensitive to fluctuations in different time scale ranges are required to obtain a faithful representation of the underlying dynamic complexity. This is especially pertinent for relaxation measurements in the solid state, which report on dynamics in a broader window of time scales by more than 3 orders of magnitudes compared to solution NMR relaxation. To aid in unraveling the intricacies of biomolecular dynamics we introduce (13)C spin-lattice relaxation in the rotating frame (R1ρ) as a probe of backbone nanosecond-microsecond motions in proteins in the solid state. We present measurements of (13)C'R1ρ rates in fully protonated crystalline protein GB1 at 600 and 850 MHz (1)H Larmor frequencies and compare them to (13)C'R1, (15)N R1 and R1ρ measured under the same conditions. The addition of carbon relaxation data to the model free analysis of nitrogen relaxation data leads to greatly improved characterization of time scales of protein backbone motions, minimizing the occurrence of fitting artifacts that may be present when (15)N data is used alone. We also discuss how internal motions characterized by different time scales contribute to (15)N and (13)C relaxation rates in the solid state and solution state, leading to fundamental differences between them, as well as phenomena such as underestimation of picosecond-range motions in the solid state and nanosecond-range motions in solution.
J Colmenero; A Arbe; F Alvarez; A Narros; D Richter; M Monkenbush; B Farago
2004-07-01
The combination of molecular dynamics simulations and neutron scattering measurements on three different glass-forming polymers (polyisoprene, poly(vinyl ethylene) and polybutadiene) has allowed to establish the existence of a crossover from Gaussian to non-Gaussian behavior for the incoherent scattering function in the -relaxation regime. The deviation from Gaussian behavior observed can be reproduced assuming the existence of a distribution of discrete jump lengths underlying the sublinear diffusion of the atomic motions during the structural relaxation.
Magnetization dynamics in rare earth doped NiFe films
Kiessling, Matthias; Woltersdorf, Georg; Back, Christian [Institut fuer Experimentelle und Angewandte Physik, Universitaet Regensburg, D- 93040 Regensburg (Germany); Thiele, Jan-Ulrich; Schabes, Manfred [Hitachi Global Storage Technologies, 3403 Yerba Buena Road, San Jose, CA 95135 (United States)
2007-07-01
The influence of rare earth dopants on the damping parameter and the resulting possibility to control this parameter were investigated. In our experiments NiFe films were doped with Dysprosium, Holmium, Terbium, and Gadolinium. The magnetization dynamics of these rare earth doped films was mainly studied by means of ferromagnetic resonance (FMR) and network-analyzer ferromagnetic resonance. It is demonstrated that the doping of a NiFe film by a small amount of rare earth elements (Holmium, Terbium and Dysprosium) greatly effects its magnetic relaxation rate. This additional damping is proportional to the doping level. Compared to the pure NiFe film it is possible to increase the damping parameter of the magnetic film by two orders of magnitude. On the other hand Gadolinium as a dopant has no influence on the damping parameter. For small dopant concentrations the in and out-of-plane FMR measurements at various frequencies can be well described by the same damping parameter. This is expected for the Gilbert damping term in the equation of motion. Therefore the increased damping can be attributed to an increased rate of transfer of angular momentum from the spin system to the lattice.
Rousochatzakis, Ioannis [Iowa State Univ., Ames, IA (United States)
2005-12-17
The field of molecular magnetism[l-6] has become a subject of intense theoretical and experimental interest and has rapidly evolved during the last years. This inter-disciplinary field concerns magnetic systems at the molecular or "nanoscopic" level, whose realization has become feasible due to recent advances in the field of chemical synthesis. The present theoretical work provides a first step towards exploiting the possibilities that are offered by probing magnetic molecules using external magnetic fields with high sweep rates. These probes, apart for providing information specific to magnetic molecules, offer the possibility of conducting a detailed study of the relaxational behavior of interacting spin systems as a result of their coupling with a "heat bath" and in particular the excitations of the host lattice. Development of a broad theoretical framework for dealing with relaxational phenomena induced by dynamical magnetic fields is indeed a worthy goal.
Kreuzer, Peter M; Poeppl, Timm B; Bulla, Jan; Schlee, Winfried; Lehner, Astrid; Langguth, Berthold; Schecklmann, Martin
2016-10-01
Interference of ongoing neuronal activity and brain stimulation motivated this study to combine repetitive transcranial magnetic stimulation (rTMS) and relaxation techniques in tinnitus patients. Forty-two patients were enrolled in this one-arm proof-of-concept study to receive ten sessions of rTMS applied to the left dorsolateral prefrontal cortex and temporo-parietal cortex. During stimulation, patients listened to five different kinds of relaxation audios. Variables of interest were tinnitus questionnaires, tinnitus numeric rating scales, depressivity, and quality of life. Results were compared to results of historical control groups having received the same rTMS protocol (active control) and sham treatment (placebo) without relaxation techniques. Thirty-eight patients completed the treatment, drop-out rates and adverse events were low. Responder rates (reduction in tinnitus questionnaire (TQ) score ≥5 points 10 weeks after treatment) were 44.7 % in the study, 27.8 % in the active control group, and 21.7 % in the placebo group, differing between groups on a near significant level. For the tinnitus handicap inventory (THI), the main effect of group was not significant. However, linear mixed model analyses showed that the relaxation/rTMS group differed significantly from the active control group showing steeper negative THI trend for the relaxation/rTMS group indicating better amelioration over the course of the trial. Deepness of relaxation during rTMS and selection of active relaxation vs. passive listening to music predicted larger TQ. All remaining secondary outcomes turned out non-significant. This combined treatment proved to be a safe, feasible and promising approach to enhance rTMS treatment effects in chronic tinnitus.
Kiryutin, Alexey; Ivanov, Konstantin; Yurkovskaya, Alexandra; Vieth, Hans-Martin
2008-01-01
By combining magnetic field cycling in the range from 0.1mT to 7T with high-resolution NMR detection the T(1) relaxation dispersion (nuclear magnetic relaxation dispersion (NMRD)) of protons in the nucleotides adenosine mono-phosphate and guanosine mono-phosphate was measured in a site-specific way. While at high field the individual spins have distinctly different T(1) times, their scalar spin-spin interaction fulfills at low field the condition of strong coupling and leads to convergence of their T(1) dispersion curves. In addition, the spin-spin coupling can lead to oscillatory components in the relaxation kinetics traceable to a coupling between spin polarization and coherence in the relaxation process. As a consequence the NMRD curves do not directly reflect the spectral density function of the motional processes, but the effects of motion and spin coupling must be separated for a reliable evaluation. A theoretical approach is described allowing such an analysis.
Noebauer-Huhmann, Iris M; Szomolanyi, Pavol; Juras, Vladimír; Kraff, Oliver; Ladd, Mark E; Trattnig, Siegfried
2010-09-01
PURPOSE/INTRODUCTION: The aim of this study was to determine the T1 relaxivities (r1) of 8 gadolinium (Gd)-based MR contrast agents in human blood plasma at 7 Tesla, compared with 3 Tesla. Eight commercially available Gd-based MR contrast agents were diluted in human blood plasma to concentrations of 0, 0.25, 0.5, 1, and 2 mmol/L. In vitro measurements were performed at 37 degrees C, on a 7 Tesla and on a 3 Tesla whole-body magnetic resonance imaging scanner. For the determination of T1 relaxation times, Inversion Recovery Sequences with inversion times from 0 to 3500 ms were used. The relaxivities were calculated. The r1 relaxivities of all agents, diluted in human blood plasma at body temperature, were lower at 7 Tesla than at 3 Tesla. The values at 3 Tesla were comparable to those published earlier. Notably, in some agents, a minor negative correlation of r1 with a concentration of up to 2 mmol/L could be observed. This was most pronounced in the agents with the highest protein-binding capacity. At 7 Tesla, the in vitro r1 relaxivities of Gd-based contrast agents in human blood plasma are lower than those at 3 Tesla. This work may serve as a basis for the application of Gd-based MR contrast agents at 7 Tesla. Further studies are required to optimize the contrast agent dose in vivo.
Large-scale dynamics of magnetic helicity
Linkmann, Moritz; Dallas, Vassilios
2016-11-01
In this paper we investigate the dynamics of magnetic helicity in magnetohydrodynamic (MHD) turbulent flows focusing at scales larger than the forcing scale. Our results show a nonlocal inverse cascade of magnetic helicity, which occurs directly from the forcing scale into the largest scales of the magnetic field. We also observe that no magnetic helicity and no energy is transferred to an intermediate range of scales sufficiently smaller than the container size and larger than the forcing scale. Thus, the statistical properties of this range of scales, which increases with scale separation, is shown to be described to a large extent by the zero flux solutions of the absolute statistical equilibrium theory exhibited by the truncated ideal MHD equations.
The Origin and Dynamics of Solar Magnetism
Thompson, M. J; Culhane, J. L; Nordlund, Å; Solanki, S. K; Zahn, J.-P
2009-01-01
The articles collected in this volume present all aspects of solar magnetism: from its origin in the solar dynamo to its evolution and dynamics that create the variability of solar phenomena, its well-known 11-year activity cycle that leads to the ever-changing pattern of sunspots and active regions on the Sun. Several contributions deal with the solar dynamo, the driver of many solar phenomena. Other contributions treat the transport and emergence of the magnetic flux through the outer layers of the Sun. The coupling of magnetic fields from the surface to the solar corona and beyond is also described, together with current studies on the predictability of solar activity. This book is aimed at researchers and graduate students working in solar physics and space science. It provides a full review of our current understanding of solar magnetism by the foremost experts in the field.
Molecular dynamics simulations of magnetized dusty plasmas
Piel, Alexander; Reichstein, Torben; Wilms, Jochen
2012-10-01
The combination of the electric field that confines a dust cloud with a static magnetic field generally leads to a rotation of the dust cloud. In weak magnetic fields, the Hall component of the ion flow exerts a drag force that sets the dust in rotation. We have performed detailed molecular-dynamics simulations of the dynamics of torus-shaped dust clouds in anodic plasmas. The stationary flow [1] is characterized by a shell structure in the laminar dust flow and by the spontaneous formation of a shear-flow around a stationary vortex. Here we present new results on dynamic phenomena, among them fluctuations due to a Kelvin-Helmholtz instability in the shear-flow. The simulations are compared with experimental results. [4pt] [1] T. Reichstein, A. Piel, Phys. Plasmas 18, 083705 (2011)
Berton, A.; Chaussy, J.; Odin, J.; Peyrard, J.; Prejean, J. J.; Souletie, J.
1981-01-01
We present measurements of the relaxations of the remanent magnetization and of the energy flux on the same samples of Au Fe spin glass (4 at % and 6 at %) at several temperatures below the temperature T G of the susceptibility cusp. The observed relaxations can be expressed in terms of the unique composite variable T ℓnt/τ which implies the existence of thermally activated asymetrical double well potentials. A consequency of this observation is the existence of a time and temperature contribution to the specific heat which is investigated directly and compared with expectation.
Gilani, Syed Irtiza Ali
2008-09-15
Recent technological developments in the field of magnetic resonance imaging have resulted in advanced techniques that can reduce the total time to acquire images. For applications such as relaxation time mapping, which enables improved visualisation of in vivo structures, rapid imaging techniques are highly desirable. TAPIR is a Look- Locker-based sequence for high-resolution, multislice T{sub 1} relaxation time mapping. Despite the high accuracy and precision of TAPIR, an improvement in the k-space sampling trajectory is desired to acquire data in clinically acceptable times. In this thesis, a new trajectory, termed line-sharing, is introduced for TAPIR that can potentially reduce the acquisition time by 40 %. Additionally, the line-sharing method was compared with the GRAPPA parallel imaging method. These methods were employed to reconstruct time-point images from the data acquired on a 4T high-field MR research scanner. Multislice, multipoint in vivo results obtained using these methods are presented. Despite improvement in acquisition speed, through line-sharing, for example, motion remains a problem and artefact-free data cannot always be obtained. Therefore, in this thesis, a rapid technique is introduced to estimate in-plane motion. The presented technique is based on calculating the in-plane motion parameters, i.e., translation and rotation, by registering the low-resolution MR images. The rotation estimation method is based on the pseudo-polar FFT, where the Fourier domain is composed of frequencies that reside in an oversampled set of non-angularly, equispaced points. The essence of the method is that unlike other Fourier-based registration schemes, the employed approach does not require any interpolation to calculate the pseudo-polar FFT grid coordinates. Translation parameters are estimated by the phase correlation method. However, instead of two-dimensional analysis of the phase correlation matrix, a low complexity subspace identification of the phase
Tóth É, Éva; Helm, Lothar; Merbach, André E.; Hedinger, Roman; Hegetschweiler, Kaspar; Jánossy, András
1998-08-10
The trinuclear [Gd(3)(H(-)(3)taci)(2)(H(2)O)(6)](3+) complex has been characterized in aqueous solution as a model compound from the point of view of MRI: the parameters that affect proton relaxivity have been determined in a combined variable temperature, pressure, and multiple-field (17)O NMR, EPR, and NMRD study. The solution structure of the complex was found to be the same as in solid state: the total coordination number of the lanthanide(III) ion is 8 with two inner-sphere water molecules. EPR measurements proved a strong intramolecular dipole-dipole interaction between Gd(III) electron spins. This mechanism dominates electron spin relaxation at high magnetic fields (B > 5 T). Its proportion to the overall relaxation decreases with decreasing magnetic field and becomes a minor term at fields used in MRI. Consequently, it cannot increase the electronic relaxation rates to such an extent that they limit proton relaxivity. [Gd(3)(H(-)(3)taci)(2)(H(2)O)(6)](3+) undergoes a relatively slow water exchange (k(ex)(298) = (1.1 +/- 0.2) x 10(7) s(-1)) compared to the Gd(III) aqua ion, while the mechanism is much more associatively activated as shown by the activation volume (DeltaV () = (-12.7 +/- 1.5) cm(3) mol(-)(1)). The lower exchange rate, as compared to [Gd(H(2)O)(8)](3+) and [Gd(PDTA)(H(2)O)(2)](-), can be explained with the higher rigidity of the [Gd(3)(H(-)(3)taci)(2)(H(2)O)(6)](3+) which considerably slows down the transition from the eight-coordinate reactant to the nine-coordinate transition state. The unexpectedly low rotational correlation time of the complex is interpreted in terms of a spherical structure with a large hydrophobic surface avoiding the formation of a substantial hydration sphere around [Gd(3)(H(-)(3)taci)(2)(H(2)O)(6)](3+).
Lin, D.P.; Feng, D.F.; Ngo, F.Q.H.; Kevan, L.
1976-11-15
Electron--electron double resonance (ELDOR) has been used to measure cross-relaxation times between trapped electrons and trapped radicals produced by ..gamma.. irradiation of 2-methyltetrahydrofuran and 3-methylhexane organic glasses. The cross-relaxation times are measured as a function of temperature, radiation dose, and the frequency difference ..delta..f of the microwave frequencies used. The cross-relaxation times are nearly temperature independent and depend on ..delta..f/sup 2/ at doses where the spin concentrations approach uniformity; these features indicate the dominance of single step over multistep cross-relaxation processes. Equations have been derived to relate the dipolar cross-relaxation distance to the measured cross-relaxation times, and it is suggested that the cross-relaxation line shape is Lorentzian in magnetically dilute systems. Typical electron--radical correlation distances in these organic glasses are 10 A. (AIP)
Molecular dynamics and composition of crude oil by low-field nuclear magnetic resonance.
Jia, Zijian; Xiao, Lizhi; Wang, Zhizhan; Liao, Guangzhi; Zhang, Yan; Liang, Can
2016-08-01
Nuclear magnetic resonance (NMR) techniques are widely used to identify pure substances and probe protein dynamics. Oil is a complex mixture composed of hydrocarbons, which have a wide range of molecular size distribution. Previous work show that empirical correlations of relaxation times and diffusion coefficients were found for simple alkane mixtures, and also the shape of the relaxation and diffusion distribution functions are related to the composition of the fluids. The 2D NMR is a promising qualitative evaluation method for oil composition. But uncertainty in the interpretation of crude oil indicated further study was required. In this research, the effect of each composition on relaxation distribution functions is analyzed in detail. We also suggest a new method for prediction of the rotational correlation time distribution of crude oil molecules using low field NMR (LF-NMR) relaxation time distributions. A set of down-hole NMR fluid analysis system is independently designed and developed for fluid measurement. We illustrate this with relaxation-relaxation correlation experiments and rotational correlation time distributions on a series of hydrocarbon mixtures that employ our laboratory-designed downhole NMR fluid analyzer. The LF-NMR is a useful tool for detecting oil composition and monitoring oil property changes. Copyright © 2016 John Wiley & Sons, Ltd.
Dynamic Characterization of Thin Film Magnetic Materials
Gu, Wei
A broadband dynamic method for characterizing thin film magnetic material is presented. The method is designed to extract the permeability and linewidth of thin magnetic films from measuring the reflection coefficient (S11) of a house-made and short-circuited strip line testing fixture with or without samples loaded. An adaptive de-embedding method is applied to remove the parasitic noise of the housing. The measurements were carried out with frequency up to 10GHz and biasing magnetic fields up to 600 Gauss. Particular measurement setup and 3-step experimental procedures are described in detail. The complex permeability of a 330nm thick continuous FeGaB, 435nm thick laminated FeGaB film and a 100nm thick NiFe film will be induced dynamically in frequency-biasing magnetic field spectra and compared with a theoretical model based on Landau-Lifshitz-Gilbert (LLG) equations and eddy current theories. The ferromagnetic resonance (FMR) phenomenon can be observed among these three magnetic materials investigated in this thesis.
Evaluation of biexponential relaxation behaviour in the human brain by magnetic resonance imaging
Kjaer, L; Thomsen, C; Henriksen, O
1989-01-01
echoes. No genuine biexponentiality was demonstrated in the T1 and T2 relaxation processes of white matter, cortical grey matter, or cerebrospinal fluid. Thus, a monoexponential model seems adequate for description of the relaxation behaviour in these cases. Furthermore, the results suggest...
Adelerhof, D.J.; Duuren, van M.J.; Flokstra, J.; Rogalla, H.; Kawai, J.; Kado, H.
1995-01-01
The experimental sensitivity of double relaxation oscillation SQUIDs (DROSs) has been compared with theory and with the results obtained by numerical simulations. The experimental sensitivity ranges from 60 to 13h, where h is Planck's constant, for relaxation frequencies from 0.4 up to 10 GHz. For l
Adelerhof, D.J.; Adelerhof, Derk Jan; van Duuren, M.J.; Flokstra, Jakob; Rogalla, Horst; Kawai, J.; Kado, H.
1995-01-01
The experimental sensitivity of double relaxation oscillation SQUIDs (DROSs) has been compared with theory and with the results obtained by numerical simulations. The experimental sensitivity ranges from 60 to 13h, where h is Planck's constant, for relaxation frequencies from 0.4 up to 10 GHz. For
Prompers, J J; Brüschweiler, R
2001-08-01
An approach is presented for the interpretation of heteronuclear NMR spin relaxation data in mobile protein parts in terms of reorientational eigenmode dynamics. The method is based on the covariance matrix of the spatial functions of the nuclear spin interactions that cause relaxation expressed as spherical harmonics of rank 2. The approach was applied to characterize the dynamics of a loop region of ubiquitin. The covariance matrix was determined from a conformational ensemble generated by a 5 ns molecular dynamics simulation. It was found that the time correlation functions of the dominant eigenmodes decay in good approximation with a single correlation time. From the reorientational eigenmodes, their eigenvalues, and correlation times, NMR relaxation data were calculated in accordance with Bloch-Wangsness-Redfield relaxation theory and directly compared with experimental (15)N relaxation parameters. Using a fitting procedure, agreement between calculated and experimental data was improved significantly by adjusting eigenvalues and correlation times of the dominant modes. The presented procedure provides detailed information on correlated reorientational dynamics of flexible parts in globular proteins. The covariance matrix was linked to the covariance matrix of backbone dihedral angle fluctuations, allowing one to study the motional behavior of these degrees of freedom on nano- and subnanosecond time scales.
Microscopic origins of the terahertz carrier relaxation and cooling dynamics in graphene
Mihnev, Momchil T.; Kadi, Faris; Divin, Charles J.; Winzer, Torben; Lee, Seunghyun; Liu, Che-Hung; Zhong, Zhaohui; Berger, Claire; de Heer, Walt A.; Malic, Ermin; Knorr, Andreas; Norris, Theodore B.
2016-01-01
The ultrafast dynamics of hot carriers in graphene are key to both understanding of fundamental carrier–carrier interactions and carrier–phonon relaxation processes in two-dimensional materials, and understanding of the physics underlying novel high-speed electronic and optoelectronic devices. Many recent experiments on hot carriers using terahertz spectroscopy and related techniques have interpreted the variety of observed signals within phenomenological frameworks, and sometimes invoke extrinsic effects such as disorder. Here, we present an integrated experimental and theoretical programme, using ultrafast time-resolved terahertz spectroscopy combined with microscopic modelling, to systematically investigate the hot-carrier dynamics in a wide array of graphene samples having varying amounts of disorder and with either high or low doping levels. The theory reproduces the observed dynamics quantitatively without the need to invoke any fitting parameters, phenomenological models or extrinsic effects such as disorder. We demonstrate that the dynamics are dominated by the combined effect of efficient carrier–carrier scattering, which maintains a thermalized carrier distribution, and carrier–optical–phonon scattering, which removes energy from the carrier liquid. PMID:27221060
Nonequilibrium dynamics and ultraslow relaxation of confined DNA during viral packaging.
Berndsen, Zachary T; Keller, Nicholas; Grimes, Shelley; Jardine, Paul J; Smith, Douglas E
2014-06-10
Many viruses use molecular motors that generate large forces to package DNA to near-crystalline densities inside preformed viral proheads. Besides being a key step in viral assembly, this process is of interest as a model for understanding the physics of charged polymers under tight 3D confinement. A large number of theoretical studies have modeled DNA packaging, and the nature of the molecular dynamics and the forces resisting the tight confinement is a subject of wide debate. Here, we directly measure the packaging of single DNA molecules in bacteriophage phi29 with optical tweezers. Using a new technique in which we stall the motor and restart it after increasing waiting periods, we show that the DNA undergoes nonequilibrium conformational dynamics during packaging. We show that the relaxation time of the confined DNA is >10 min, which is longer than the time to package the viral genome and 60,000 times longer than that of the unconfined DNA in solution. Thus, the confined DNA molecule becomes kinetically constrained on the timescale of packaging, exhibiting glassy dynamics, which slows the motor, causes significant heterogeneity in packaging rates of individual viruses, and explains the frequent pausing observed in DNA translocation. These results support several recent hypotheses proposed based on polymer dynamics simulations and show that packaging cannot be fully understood by quasistatic thermodynamic models.
Coupling of caged molecule dynamics to Johari-Goldstein β-relaxation in metallic glasses
Wang, Z.; Ngai, K. L.; Wang, W. H.; Capaccioli, S.
2016-01-01
Three recently published papers have discovered a general property of the fast caged dynamics observed in the glassy states of polyalcohols (S. Capaccioli et al., J. Phys. Chem. B 119, 8800 (2015)), amorphous polymers (K. L. Ngai et al., J. Phys. Chem. B 119, 12502 (2015)), and van der Waals molecular glass-formers (K. L. Ngai et al., J. Phys. Chem. B 119, 12519 (2015)). The fast caged dynamics are manifested as nearly constant loss (NCL) in dielectric and mechanical susceptibility. Shown before in these papers is the intensity of the caged dynamics change temperature dependence at a temperature THF nearly coincident with the secondary glass transition temperature Tgβ, at which the Johari-Goldstein (JG) β-relaxation time τJG reaches ˜103 s. Evidently this finding indicates the coupling of the caged dynamics to the secondary glass transition. The glass-formers considered so far are all soft matters. However, the generality of the phenomenon and its explanation implies that the relation, THF ≈ Tgβ, should be observed in other classes of glass-formers. In this paper, we extend the consideration of the phenomenon and explanation to metallic glasses, which are not soft matter. The experimental data presented show the same phenomenon, supporting its generality and fundamental importance in the physics of glass and glass transition.
Kaman, Ondřej; Kuličková, Jarmila; Herynek, Vít; Koktan, Jakub; Maryško, Miroslav; Dědourková, Tereza; Knížek, Karel; Jirák, Zdeněk
2017-04-01
Hydrothermal synthesis of Mn1-xZnxFe2O4 nanoparticles followed by direct encapsulation of the as-grown material into silica is demonstrated as a fast and facile method for preparation of efficient negative contrast agents based on clusters of ferrite crystallites. At first, the hydrothermal procedure is optimized to achieve strictly single-phase magnetic nanoparticles of Mn-Zn ferrites in the compositional range of x≈0.2-0.6 and with the mean size of crystallites ≈10 nm. The products are characterized by powder X-ray diffraction, X-ray fluorescence spectroscopy, and SQUID magnetometry, and the composition close to x=0.4 is selected for the preparation of silica-coated clusters with the mean diameter of magnetic cores ≈25 nm. Their composite structure is studied by means of transmission electron microscopy combined with detailed image analysis and magnetic measurements in DC fields. The relaxometric studies, performed in the magnetic field of B0=0.5 T, reveal high transverse relaxivity (r2(20 °C)=450 s-1 mmol(Me3O4)-1 L) with a pronounced temperature dependence, which correlates with the observed temperature dependence of magnetization and is ascribed to a mechanism of transverse relaxation similar to the motional averaging regime.
Phong, Pham Thanh; Nguyen, Luu Huu; Manh, Do Hung; Lee, In-Ja; Phuc, Nguyen Xuan
2017-04-01
In this study, the degree of the contribution of particular relaxation losses to the specific loss power are calculated for a number of magnetic fluids, including Fe3O4, CoFe2O4, MnFe2O4, FeCo, FePt and La0.7Sr0.3MnO3 nanoparticles in various viscosities. We found that the specific loss of every fluid studied increases linearly with particle saturation magnetization. The competition between Néel and Brownian relaxation contributions gives rise to a peak at a critical diameter in the plot of specific loss power versus diameter. The critical diameter does not change with saturation magnetization but monotonically decreases with increasing magnetic anisotropy. If particle diameter is smaller than 6-11 nm, the maximum loss power tends to diminish and the heating effect to switch off. According to how the materials respond to viscosity change, the hyperthermia materials can be classified into two groups. One is hard nanoparticles with high anisotropy of which the critical diameter decreases with viscosity and the specific loss power versus saturation magnetization rate decreases strongly. The other is soft nanoparticles with low anisotropy of which the properties are insensitive to the viscosity of the fluid. We discuss our simulated results in relation to recent experimental findings.
Vallejo, Julia; Castro, Isabel; Ruiz-García, Rafael; Cano, Joan; Julve, Miguel; Lloret, Francesc; De Munno, Giovanni; Wernsdorfer, Wolfgang; Pardo, Emilio
2012-09-26
The novel mononuclear Co(II) complex cis-[Co(II)(dmphen)(2)(NCS)(2)]·0.25EtOH (1) (dmphen = 2,9-dimethyl-1,10-phenanthroline) features a highly rhombically distorted octahedral environment that is responsible for the strong positive axial and rhombic magnetic anisotropy of the high-spin Co(II) ion (D = +98 cm(-1) and E = +8.4 cm(-1)). Slow magnetic relaxation effects were observed for 1 in the presence of a dc magnetic field, constituting the first example of field-induced single-molecule magnet behavior in a mononuclear six-coordinate Co(II) complex with a transverse anisotropy energy barrier.
Cariati, Elena; Ugo, Renato; Santoro, Giuseppe; Tordin, Elisa; Sorace, Lorenzo; Caneschi, Andrea; Sironi, Angelo; Macchi, Piero; Casati, Nicola
2010-12-06
New Co(II) members of the family of multifunctional materials of general formula [DAMS](4)[M(2)Co(C(2)O(4))(6)]·2DAMBA·2H(2)O (M(III) = Rh, Fe, Cr; DAMBA = para-dimethylaminobenzaldehyde and [DAMS(+)] = trans-4-(4-dimethylaminostyryl)-1-methylpyridinium) have been isolated and characterized. Such new hybrid mixed metal oxalates are isostructural with the previously investigated containing Zn(II), Mn(II), and Ni(II). This allows to preserve the exceptional second harmonic generation (SHG) activity, due to both the large molecular quadratic hyperpolarizability of [DAMS(+)] and the efficiency of the crystalline network which organizes [DAMS(+)] into head-to-tail arranged J-type aggregates, and to further tune the magnetic properties. In particular, the magnetic data of the Rh(III) derivative demonstrate that high spin octacoordinated Co(II) centers behave very similarly to the hexacoordinated Co(II) ones, being dominated by a large orbital contribution. The Cr(III) derivative is characterized by ferromagnetic Cr(III)-Co(II) interactions. Most relevantly, the Fe(III) compound is characterized by a moderate antiferromagnetic interaction between Fe(III) and Co(II), resulting in a ferrimagnetic like structure. Its low temperature dynamic magnetic properties were found to follow a thermally activated behavior (τ(0) = 8.6 × 10(-11) s and ΔE = 21.4 K) and make this a candidate for the second oxalate-based single chain magnet (SCM) reported up to date, a property which in this case is coupled to the second order non linear optical (NLO) ones.
Modified relaxation dynamics and coherent energy exchange in coupled vibration-cavity polaritons
Dunkelberger, A. D.; Spann, B. T.; Fears, K. P.; Simpkins, B. S.; Owrutsky, J. C.
2016-11-01
Coupling vibrational transitions to resonant optical modes creates vibrational polaritons shifted from the uncoupled molecular resonances and provides a convenient way to modify the energetics of molecular vibrations. This approach is a viable method to explore controlling chemical reactivity. In this work, we report pump-probe infrared spectroscopy of the cavity-coupled C-O stretching band of W(CO)6 and the direct measurement of the lifetime of a vibration-cavity polariton. The upper polariton relaxes 10 times more quickly than the uncoupled vibrational mode. Tuning the polariton energy changes the polariton transient spectra and relaxation times. We also observe quantum beats, so-called vacuum Rabi oscillations, between the upper and lower vibration-cavity polaritons. In addition to establishing that coupling to an optical cavity modifies the energy-transfer dynamics of the coupled molecules, this work points out the possibility of systematic and predictive modification of the excited-state kinetics of vibration-cavity polariton systems.
Ultrafast charge generation and relaxation dynamics in methylammonium lead bromide perovskites
Deng, Xiaofan; Wen, Xiaoming; Sheng, Rui; Huang, Shujuan; Harada, Takaaki; Kee, Tak W.; Green, Martin A.; Ho-Baillie, Anita
2015-12-01
Methylammonium Lead Bromide (CH3NH3PbBr3) is a promising material for tandem solar cell due to its high band gap. Ultrafast optical techniques on a time scale of femto- and picosecond are used to investigate the carrier dynamics in CH3NH3PbBr3. An ultrafast cooling of hot carriers occurs in sub-picoseconds in CH3NH3PbBr3 by phonon scattering. Two ultrafast relaxation processes are attributed to optical phonon scattering and acoustic phonon scattering. The relaxation processes are evidently slower when CH3NH3PbBr3 is in contact with compact TiO2 (c-TiO2) layer, suggesting better quality CH3NH3PbBr3. when deposited on c-TiO2. The nanosecond decay in CH3NH3PbBr3 film is ascribed to electron-hole recombination. With the presence of c-TiO2 layer, this process is accelerated due to electron transport across the CH3NH3PbBr3/ c-TiO2 interface.
Direct 13C-detection for carbonyl relaxation studies of protein dynamics
Pasat, Gabriela; Zintsmaster, John S.; Peng, Jeffrey W.
2008-08-01
We describe a method that uses direct 13C-detection for measuring rotating-frame carbonyl ( 13CO) relaxation rates to describe protein functional dynamics. Key advantages of method include the following: (i) unique access to 13CO groups that lack a scalar-coupled 15N- 1H group; (ii) insensitivity to 15N/ 1H exchange-broadening that can derail 1H-detected 15N and HNCO methods; (iii) avoidance of artifacts caused by incomplete water suppression. We demonstrate the approach for both backbone and side-chain 13CO groups. Accuracy of the 13C-detected results is supported by their agreement with those obtained from established HNCO-based approaches. Critically, we show that the 13C-detection approach provides access to the 13CO groups of functionally important residues that are invisible via 1H-detected HNCO methods because of exchange-broadening. Hence, the 13C-based method fills gaps inherent in canonical 1H-detected relaxation experiments, and thus provides a novel complementary tool for NMR studies of biomolecular flexibility.
Keating, K.; Halsey, J.
2011-12-01
A recent interest in the use of non-invasive geophysical methods to detect the presence of and measure the growth of microbes in the subsurface has arisen due to the potential use of such methods to monitor the progress of bioremediation. Previous research to this end has focused on electrical measurements, such as complex resistivity, which are sensitive to the presence of microbes but can be difficult to interpret. Nuclear magnetic resonance (NMR), an emerging near-surface geophysical method, is sensitive to the presence and physiochemical environment of hydrogen. Typically, NMR measurements in geophysics are used to detect hydrogen in water or hydrocarbons and to determine its pore environment; however, NMR imaging measurements have shown that NMR can also detect hydrogen in microbes. Geophysical NMR measurements thus have the potential to directly detect microbes in geologic material or indirectly detect the way in which the presence of microbes alters the physical and chemical properties of a water-saturated geologic material. This laboratory-scale study was designed to explore the effect of the presence and density of microbes on NMR relaxation measurements. Measurements were collected on microbial slurries and microbes in porous media both during microbial growth and on samples with known microbial density. Shewanella oneidensis was used as a representative environmental microbe in this study. The research shows that low field NMR measurements are sensitive to the presence and density of microbes and provides fundamental information required to determine if low-field NMR measurements can be used to monitor microbial growth during bioremediation.
Magnetization dynamics in (Cd,Mn)Te quantum wells
Goryca, M.; Nawrocki, M. [Institute of Experimental Physics, Warsaw University, Hoza 69, 00-681 Warsaw (Poland); Ferrand, D.; Tatarenko, S. [Joined group ' ' Nanophysique et semiconducteurs' ' , CNRS/CEA/Universite Joseph Fourier-Grenoble, Laboratoire de Spectrometrie Physique, BP 87, 38402 Saint Martin d' Heres cedex (France); Kossacki, P.; Pacuski, W.; Maslana, W. [Institute of Experimental Physics, Warsaw University, Hoza 69, 00-681 Warsaw (Poland); Joined group ' ' Nanophysique et semiconducteurs' ' , CNRS/CEA/Universite Joseph Fourier-Grenoble, Laboratoire de Spectrometrie Physique, BP 87, 38402 Saint Martin d' Heres cedex (France); Cibert, J. [Laboratoire Louis Neel, CNRS, BP166, 38042 Grenoble cedex 9 (France)
2006-03-15
The relaxation of the magnetization change induced by a short pulse of magnetic field in p-doped (Cd,Mn)Te quantum wells is determined from the giant Zeeman shift of the photoluminescence line. The characteristic times change by three orders of magnitude upon application of a static magnetic field. (copyright 2006 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)
Ramos, Joaquim J Moura; Diogo, Hermínio P
2016-03-30
The slow molecular mobility of three active pharmaceutical drugs (voriconazole, miconazole and itraconazole) has been studied by differential scanning calorimetry (DSC) and thermally stimulated depolarization currents (TSDC). This study yielded the main kinetic features of the secondary relaxations and of the main (glass transition) relaxation, in particular their distribution of relaxation times. The dynamic fragility of the three glass formers was determined from DSC data (using two different procedures) and from TSDC data. According to our results voriconazole behaves as a relatively strong liquid, while miconazole is moderately fragile and itraconazole is a very fragile liquid. There are no studies in this area published in the literature relating to voriconazole. Also not available in the literature is a slow mobility study by dielectric relaxation spectroscopy in the amorphous miconazole. Apart from that, the results obtained are in reasonable agreement with published works using different experimental techniques. Copyright © 2016 Elsevier B.V. All rights reserved.
Emam, A.N.; Girgis, E.; Mostafa, A.A. [National Research Center, Dokki, Giza (Egypt); Guirguis, O.W. [Biophysics Department, Faculty of Science, Cairo University, Giza (Egypt); Mohamed, M.B., E-mail: monabmohamed@gmail.com [National Institute of Laser Enhanced Science, Cairo University, Giza (Egypt); NanoTech Egypt for Photoelectronics, Dreamland, Giza (Egypt)
2015-07-15
A series of colloidal CdSe quantum dots doped with different concentration of cobalt ions has been prepared via organometallic pyrolysis of a mixture of cadmium stearate and cobalt dithiocarbazate. The conditions required for successful doping depend on the source of cobalt ions and the dopant concentration. The structure and morphology of the prepared nanocrystals have been characterized using X-Ray Diffraction (XRD), and Transmission Electron Microscope (TEM). Slight shift in the interplaner space was observed in the XRD pattern of the doped nanocrystals. Formation of separate cobalt nanoclusters has been observed in the TEM images upon increasing the cobalt concentration more than 2% of the original cadmium concentration. This was confirmed by magnetic measurements of the prepared samples. Room-temperature ferromagnetism has been observed, in which the switching field increases as the cobalt ratio increases. Increasing the cobalt ratio more than 5% increases the coercivity due to formation of Co{sup 0} nanoclusters. Moreover, the presence of localized magnetic ions in semiconductor QDs leads to strong exchange interactions between sp band electrons and the magnetic ions d electrons. This would influence the optical properties such as absorption, emission, as well as nanosecond relaxation dynamics. - Graphical abstract: Display Omitted - Highlights: • Hybrid semiconductor-magnetic nanostructure was prepared via chemical method. • Room-temperature ferromagnetism for hybrid CdSe–Co quantum dots has been observed. • Co{sup +2} ions induces slight shift in the interplaner space distance of the doped QDs. • Hybrid CdSe–Co QDs have better quantum yield than pure CdSe QDs. • Hybrid CdSe–Co nanocrystals have faster electron-hole dynamics than pure CdSe QDs.
Extensional Relaxation Times and Pinch-off Dynamics of Dilute Polymer Solutions
Dinic, Jelena; Zhang, Yiran; Jimenez, Leidy; Sharma, Vivek
2015-11-01
We show that visualization and analysis of capillary-driven thinning and pinch-off dynamics of the columnar neck in an asymmetric liquid bridge created by dripping-onto-substrate can be used for characterizing the extensional rheology of complex fluids. Using a particular example of dilute, aqueous PEO solutions, we show the measurement of both the extensional relaxation time and extensional viscosity of weakly elastic, polymeric complex fluids with low shear viscosity ηsessile drop to a nozzle is detected optically, and the extensional response for viscoelastic fluids is characterized by analyzing their elastocapillary self-thinning, we refer to this technique as optically-detected elastocapillary self-thinning dripping-onto-substrate (ODES-DOS) extensional rheometry.
Coupling dynamics of Nb/Nb2O5 relaxation oscillators.
Li, Shuai; Liu, Xinjun; Nandi, Sanjoy Kumar; Venkatachalam, Dinesh Kumar; Elliman, Robert Glen
2017-03-24
The coupling dynamics of capacitively coupled Nb/Nb2O5 relaxation oscillators are shown to exhibit rich collective behaviour depending on the negative differential resistance response of the individual devices, the operating voltage and the coupling capacitance. These coupled oscillators are shown to exhibit stable frequency and phase locking states at source voltages as low as 2.2 V, with frequency control in the range from 0.85 to 16.2 MHz and frequency tunability of ∼8 MHz V(-1). The experimental realisation of such compact, scalable and low power coupled-oscillator systems is of particular significance for the development and implementation of large oscillator networks in non-Boolean computing architectures.
Molecular-dynamics study of amorphous SiO{sub 2} relaxation
Fadhilah, Irfan Muhammad, E-mail: irfanmuhammadf@ymail.com [Department of Physics, Universitas Padjadjaran, Jatinangor, Sumedang 45363 (Indonesia); Rosandi, Yudi, E-mail: rosandi@geophys.unpad.ac.id [Theoretical and Computational Geophysics Laboratory, Department of Physics, Universitas Padjadjaran, Jatinangor, Sumedang 45363 (Indonesia)
2015-09-30
Using Molecular-Dynamics simulation we observed the generation of amorphous SiO{sub 2} target from a randomly distributed Si and O atoms. We applied a sequence of annealing of the target with various temperature and quenching to room temperature. The relaxation time required by the system to form SiO{sub 4} tetrahedral mesh after a relatively long simulation time, is studied. The final amorphous target was analyzed using the radial distribution function method, which can be compared with the available theoretical and experimental data. We found that up to 70% of the target atoms form the tetrahedral SiO{sub 4} molecules. The number of formed tetrahedral increases following the growth function and the rate of SiO{sub 4} formation follows Arrhenius law, depends on the annealing temperature. The local structure of amorphous SiO{sub 2} after this treatment agrees well with those reported in some literatures.
Dipolar Relaxation Dynamics at the Active Site of an ATPase Regulated by Membrane Lateral Pressure.
Fischermeier, Elisabeth; Pospíšil, Petr; Sayed, Ahmed; Hof, Martin; Solioz, Marc; Fahmy, Karim
2017-01-24
The active transport of ions across biological membranes requires their hydration shell to interact with the interior of membrane proteins. However, the influence of the external lipid phase on internal dielectric dynamics is hard to access by experiment. Using the octahelical transmembrane architecture of the copper-transporting P1B -type ATPase from Legionella pneumophila as a model structure, we have established the site-specific labeling of internal cysteines with a polarity-sensitive fluorophore. This enabled dipolar relaxation studies in a solubilized form of the protein and in its lipid-embedded state in nanodiscs. Time-dependent fluorescence shifts revealed the site-specific hydration and dipole mobility around the conserved ion-binding motif. The spatial distribution of both features is shaped significantly and independently of each other by membrane lateral pressure. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.
Poulsen, Jens Aage; Rossky, Peter J.
2001-11-01
We present a method based on centroid molecular dynamics (CMD) to calculate nonlinear quantum force correlation functions important in the golden rule approach for studying vibrational energy relaxation (VER) in condensed phases. We consider a model of a diatomic molecule in a two-dimensional neon liquid and also a diatomic coupled to a small Helium cluster. The predictions of the theory for the neon bath are compared and found in close agreement with available theories for VER based on the Egelstaff correction factor and Feynman-Kleinert variational theory. For the Helium cluster, the force spectrum obtained from CMD is found to be in slightly better agreement with the exact result than a method based on a cumulant approach. The results support the use of CMD in condensed phase studies of VER when quantum effects are important.
Multiscale Model Approach for Magnetization Dynamics Simulations
De Lucia, Andrea; Tretiakov, Oleg A; Kläui, Mathias
2016-01-01
Simulations of magnetization dynamics in a multiscale environment enable rapid evaluation of the Landau-Lifshitz-Gilbert equation in a mesoscopic sample with nanoscopic accuracy in areas where such accuracy is required. We have developed a multiscale magnetization dynamics simulation approach that can be applied to large systems with spin structures that vary locally on small length scales. To implement this, the conventional micromagnetic simulation framework has been expanded to include a multiscale solving routine. The software selectively simulates different regions of a ferromagnetic sample according to the spin structures located within in order to employ a suitable discretization and use either a micromagnetic or an atomistic model. To demonstrate the validity of the multiscale approach, we simulate the spin wave transmission across the regions simulated with the two different models and different discretizations. We find that the interface between the regions is fully transparent for spin waves with f...
Nambu mechanics for stochastic magnetization dynamics
Thibaudeau, Pascal; Nicolis, Stam
2016-01-01
The Landau-Lifshitz-Gilbert (LLG) equation describes the dynamics of a damped magnetization vector that can be understood as a generalization of Larmor spin precession. The LLG equation cannot be deduced from the Hamiltonian framework, by introducing a coupling to a usual bath, but requires the introduction of additional constraints. It is shown that these constraints can be formulated elegantly and consistently in the framework of dissipative Nambu mechanics. This has many consequences for both the variational principle and for topological aspects of hidden symmetries that control conserved quantities. We particularly study how the damping terms of dissipative Nambu mechanics affect the consistent interaction of magnetic systems with stochastic reservoirs and derive a master equation for the magnetization. The proposals are supported by numerical studies using symplectic integrators that preserve the topological structure of Nambu equations. These results are compared to computations performed by direct samp...
Liu, H. W.; Yang, K. F.; Mishima, T. D.; Santos, M. B.; Hirayama, Y.
2010-12-01
We present dynamic nuclear polarization (DNP) in the simplest pseudospin quantum Hall ferromagnet (QHF) of an InSb two-dimensional electron gas with a large g factor using tilted magnetic fields. The DNP-induced amplitude change in a resistance spike of the QHF at large current enables observation of the resistively detected nuclear magnetic resonance of the high nuclear spin isotope I115n with nine quadrupole splittings. Our results demonstrate the importance of domain structures in the DNP process. The nuclear spin relaxation time T1 in this QHF was relatively short (˜120s) and almost temperature independent.
A stochastic model for magnetic dynamics in single-molecule magnets
López-Ruiz, R., E-mail: rlruiz@ifi.unicamp.br [Instituto de Física Gleb Wataghin - Universidade Estadual de Campinas, 13083-859 Campinas (SP) (Brazil); Almeida, P.T. [Instituto de Física Gleb Wataghin - Universidade Estadual de Campinas, 13083-859 Campinas (SP) (Brazil); Vaz, M.G.F. [Instituto de Química, Universidade Federal Fluminense, 24020-150 Niterói (RJ) (Brazil); Novak, M.A. [Instituto de Física - Universidade Federal do Rio de Janeiro, 21941-972 Rio de Janeiro (RJ) (Brazil); Béron, F.; Pirota, K.R. [Instituto de Física Gleb Wataghin - Universidade Estadual de Campinas, 13083-859 Campinas (SP) (Brazil)
2016-04-01
Hysteresis and magnetic relaxation curves were performed on double well potential systems with quantum tunneling possibility via stochastic simulations. Simulation results are compared with experimental ones using the Mn{sub 12} single-molecule magnet, allowing us to introduce time dependence in the model. Despite being a simple simulation model, it adequately reproduces the phenomenology of a thermally activated quantum tunneling and can be extended to other systems with different parameters. Assuming competition between the reversal modes, thermal (over) and tunneling (across) the anisotropy barrier, a separation of classical and quantum contributions to relaxation time can be obtained. - Highlights: • Single-molecule magnets are modeled using a simple stochastic approach. • Simulation reproduces thermally-activated tunnelling magnetization reversal features. • The time is introduced in hysteresis and relaxation simulations. • We can separate the quantum and classical contributions to decay time.
Praveena, K.; Chen, Hsiao-Wen; Liu, Hsiang-Lin; Sadhana, K.; Murthy, S. R.
2016-12-01
Nowadays electronic industries prerequisites magnetic materials, i.e., iron rich materials and their magnetic alloys. However, with the advent of high frequency applications, the standard techniques of reducing eddy current losses, using iron cores, were no longer efficient or cost effective. Current market trends of the switched mode power supplies industries required even low energy losses in power conversion with maintenance of adequate initial permeability. From the above point of view, in the present study we aimed at the production of Manganese-Zinc ferrites prepared via solution combustion method using mixture of fuels and achieved low loss, high saturation magnetization, high permeability, and high magnetic domain relaxation frequency. The as-synthesized Zn2+ substituted MnFe2O4 were characterized by X-ray diffractometer (XRD) and transmission electron microscopy (TEM). The fractions of Mn2+, Zn2+ and Fe2+ cations occupying tetrahedral sites along with Fe occupying octahedral sites within the unit cell of all ferrite samples were estimated by Raman scattering spectroscopy. The magnetic domain relaxation was investigated by inductance spectroscopy (IS) and the observed magnetic domain relaxation frequency (fr) was increased with the increase in grain size. The real and imaginary part of permeability (μ‧ and μ″) increased with frequency and showed a maximum above 100 MHz. This can be explained on the basis of spin rotation and domain wall motion. The saturation magnetization (Ms), remnant magnetization (Mr) and magneton number (μB) decreased gradually with increasing Zn2+ concentration. The decrease in the saturation magnetization was discussed with Yafet-Kittel (Y-K) model. The Zn2+ concentration increases the relative number of ferric ions on the A sites, reduces the A-B interactions. The frequency dependent total power losses decreased as the zinc concentration increased. At 1 MHz, the total power loss (Pt) changed from 358 mW/cm3 for x=0-165 mW/cm3
Shiba, Hayato; Yamada, Yasunori; Kawasaki, Takeshi; Kim, Kang
2016-12-01
By using large-scale molecular dynamics simulations, the dynamics of two-dimensional (2D) supercooled liquids turns out to be dependent on the system size, while the size dependence is not pronounced in three-dimensional (3D) systems. It is demonstrated that the strong system-size effect in 2D amorphous systems originates from the enhanced fluctuations at long wavelengths which are similar to those of 2D crystal phonons. This observation is further supported by the frequency dependence of the vibrational density of states, consisting of the Debye approximation in the low-wave-number limit. However, the system-size effect in the intermediate scattering function becomes negligible when the length scale is larger than the vibrational amplitude. This suggests that the finite-size effect in a 2D system is transient and also that the structural relaxation itself is not fundamentally different from that in a 3D system. In fact, the dynamic correlation lengths estimated from the bond-breakage function, which do not suffer from those enhanced fluctuations, are not size dependent in either 2D or 3D systems.
Dynamic relaxation in algebraic reconstruction technique (ART) for breast tomosynthesis imaging.
Oliveira, N; Mota, A M; Matela, N; Janeiro, L; Almeida, P
2016-08-01
A major challenge in Digital Breast Tomosynthesis (DBT) is handling image noise since the 3D reconstructed images are obtained from low dose projections and limited angular range. The use of the iterative reconstruction algorithm Algebraic Reconstruction Technique (ART) in clinical context depends on two key factors: the number of iterations needed (time consuming) and the image noise after iterations. Both factors depend highly on a relaxation coefficient (λ), which may give rise to slow or noisy reconstructions, when a single λ value is considered for the entire iterative process. The aim of this work is to present a new implementation for the ART that takes into account a dynamic mode to calculate λ in DBT image reconstruction. A set of initial reconstructions of real phantom data was done using constant λ values. The results were used to choose, for each iteration, the suitable λ value, taking into account the image noise level and the convergence speed. A methodology to optimize λ automatically during the image reconstruction was proposed. Results showed we can dynamically choose λ values in such a way that the time needed to reconstruct the images can be significantly reduced (up to 70%) while achieving similar image quality. These results were confirmed with one clinical dataset. With simple methodology we were able to dynamically choose λ in DBT image reconstruction with ART, allowing a shorter image reconstruction time without increasing image noise. Copyright © 2016 Elsevier Ireland Ltd. All rights reserved.
Beardsley, R. P.; Parkes, D. E.; Zemen, J.; Bowe, S.; Edmonds, K. W.; Reardon, C.; Maccherozzi, F.; Isakov, I.; Warburton, P. A.; Campion, R. P.; Gallagher, B. L.; Cavill, S. A.; Rushforth, A. W.
2017-01-01
We investigate the role of lithographically-induced strain relaxation in a micron-scaled device fabricated from epitaxial thin films of the magnetostrictive alloy Fe81Ga19. The strain relaxation due to lithographic patterning induces a magnetic anisotropy that competes with the magnetocrystalline and shape induced anisotropies to play a crucial role in stabilising a flux-closing domain pattern. We use magnetic imaging, micromagnetic calculations and linear elastic modelling to investigate a region close to the edges of an etched structure. This highly-strained edge region has a significant influence on the magnetic domain configuration due to an induced magnetic anisotropy resulting from the inverse magnetostriction effect. We investigate the competition between the strain-induced and shape-induced anisotropy energies, and the resultant stable domain configurations, as the width of the bar is reduced to the nanoscale range. Understanding this behaviour will be important when designing hybrid magneto-electric spintronic devices based on highly magnetostrictive materials. PMID:28186114
Manago, Masahiro; Yamanaka, Takayoshi; Ishida, Kenji; Mao, Zhiqiang; Maeno, Yoshiteru
2016-10-01
We carried out 101Ru nuclear quadrupole resonance (NQR) measurement on superconducting (SC) Sr2RuO4 under zero magnetic field (H =0 ) and found that the nuclear spin-spin relaxation rate 1 /T2 is enhanced in the SC state. The 1 /T2 measurement in the SC state under H =0 is effective for detecting slow magnetic fluctuations parallel to the quantized axis of the nuclear spin. Our results indicate that low-energy magnetic fluctuations perpendicular to the RuO2 plane emerge when the superconductivity sets in, which is consistent with the previous 17O-NQR result that the nuclear spin-lattice relaxation rate 1 /T1 of the in-plane O site exhibits anomalous behavior in the SC state. The enhancement of the magnetic fluctuations in the SC state is unusual and suggests that the fluctuations are related to the unconventional SC pairing. We suggest that this phenomenon is a consequence of the spin degrees of freedom of the spin-triplet pairing.
DONG DaPeng; ZHENG Hui; ZHAO Liang; ZHUANG PengFei; LIU Tao; HE Cheng; DUAN ChunYing
2012-01-01
Using BuaN[Fe(Tp*)(CN)3]-(Tp* =hydrotris(3,5-dimethylpyrazol-l-yl)borate)as the building block to react with CuⅡ and N-methylimidazole,we obtained a one-dimensional(1D)heterobimetallic cyano-bridged chain,[Fe(Tp*)(CN)3]2Cu(N- methylimidazole)2·2H2O(1).The crystal structures and magnetic studies demonstrate that complex 1 exhibits slow relaxation of the magnetization due to strong intrachain ferromagnetic coupling and weak interchain interactions.
Relaxation properties in classical diamagnetism
Carati, A.; Benfenati, F.; Galgani, L.
2011-06-01
It is an old result of Bohr that, according to classical statistical mechanics, at equilibrium a system of electrons in a static magnetic field presents no magnetization. Thus a magnetization can occur only in an out of equilibrium state, such as that produced through the Foucault currents when a magnetic field is switched on. It was suggested by Bohr that, after the establishment of such a nonequilibrium state, the system of electrons would quickly relax back to equilibrium. In the present paper, we study numerically the relaxation to equilibrium in a modified Bohr model, which is mathematically equivalent to a billiard with obstacles, immersed in a magnetic field that is adiabatically switched on. We show that it is not guaranteed that equilibrium is attained within the typical time scales of microscopic dynamics. Depending on the values of the parameters, one has a relaxation either to equilibrium or to a diamagnetic (presumably metastable) state. The analogy with the relaxation properties in the Fermi Pasta Ulam problem is also pointed out.
de Haan, Hendrick W; Paquet, Chantal
2011-12-01
The effects of including a hydrophilic coating around the particles are studied across a wide range of particle sizes by performing Monte Carlo simulations of protons diffusing through a system of magnetic particles. A physically realistic methodology of implementing the coating by cross boundary jump scaling and transition probabilities at the coating surface is developed. Using this formulation, the coating has three distinct impacts on the relaxation rate: an enhancement at small particle sizes, a degradation at intermediate particle sizes, and no effect at large particles sizes. These varied effects are reconciled with the underlying dephasing mechanisms by using the concept of a full dephasing zone to present a physical picture of the dephasing process with and without the coating for all sizes. The enhancement at small particle sizes is studied systemically to demonstrate the existence of an optimal ratio of diffusion coefficients inside/outside the coating to achieve maximal increase in the relaxation rate.
Woźniak-Braszak, Aneta
2017-02-01
Molecular dynamics of the solid 3-(trifluoromethyl) benzoic acid containing proton (1)H and fluorine (19)F nuclei was explored by the solid-state NMR off - resonance technique. Contrary to the previous experiments the proton nuclei system I relaxed in the off - resonance effective field B→e while fluorine nuclei system S was saturated for short time in comparison to the relaxation time T1I. New cross - relaxation solid - state NMR off - resonance experiments were conducted on a homebuilt pulse spectrometer operating at the on-resonance frequency of 30.2MHz, at the off - resonance frequency varied between 30.2 and 30.6MHz for protons and at the frequency of 28.411MHz for fluorines, respectively. Based on the experimental data the dispersions of the proton off - resonance spin - lattice relaxation rate ρρ(I), the fluorine off - resonance spin - lattice relaxation rate ρρ(S) and the cross - relaxation rate σρ in the rotating frame were determined. Copyright © 2016 Elsevier Inc. All rights reserved.
Fuson, Michael M.
2017-01-01
Laboratories studying the anisotropic rotational diffusion of bromobenzene using nuclear spin relaxation and molecular dynamics simulations are described. For many undergraduates, visualizing molecular motion is challenging. Undergraduates rarely encounter laboratories that directly assess molecular motion, and so the concept remains an…
Dynamics and shapes of ferrofluid drops under spatially uniform magnetic fields
Rowghanian, Payam; Serwane, Friedhelm; Kealhofer, David; Meinhart, Carl D.; Campas, Otger
2016-11-01
We study the shape and dynamics of a Newtonian ferrofluid drop immersed in a Newtonian and non-magnetic viscous fluid under the action of a uniform external magnetic field. We obtain the exact equilibrium drop shapes for arbitrary ferrofluids which describe unexplained previous experiments, characterize the extent of deviations of the exact shape from the commonly assumed ellipsoidal shape, and analyze the smoothness of highly curved tips in elongated drops. We present a comprehensive study of drop deformation for a Langevin ferrofluid. Using a computational scheme that allows fast and accurate simulations of ferrofluid drop dynamics, we show that the dynamics of drop deformation by an applied magnetic field is described up to a numerical factor by the same time scale as drop relaxation in the absence of any magnetic field. The numerical factor depends on the ratio of viscosities and the ratio of magnetic to capillary stresses, but is independent of the nature of the ferrofluid in most practical cases. Finally, we use the shape and dynamics of the magnetic drops to measure the rheology of complex fluids.
Spin-lattice relaxation study of the methyl proton dynamics in solid 9,10-dimethyltriptycene (DMT).
Piślewski, N; Tritt-Goc, J; Bielejewski, M; Rachocki, A; Ratajczyk, T; Szymański, S
2009-06-01
Proton spin-lattice relaxation studies are performed for powder samples of 9,10-dimethyltriptycene (DMT) and its isotopomer DMT-d(12) in which all the non-methyl protons in the molecule are replaced by deuterons. The relaxation data are interpreted in terms of the conventional relaxation theory based on the random jump model in which the Pauli correlations between the relevant spin and torsional states are discarded. The Arrhenius activation energies, obtained from the relaxation data, 25.3 and 24.8 kJ mol(-1) for DMT and DMT-d(12), respectively, are very high as for the methyl groups. The validity of the jump model in the present case is considered from the perspective of Haupt theory in which the Pauli principle is explicitly invoked. To this purpose, the dynamic quantities entering the Haupt model are reinterpreted in the spirit of the damped quantum rotation (DQR) approach introduced recently for the purpose of NMR lineshape studies of hindered molecular rotators. Theoretical modelling of the relevant methyl group dynamics, based on the DQR theory, was performed. From these calculations it is inferred that direct assessments of the torsional barrier heights, based on the Arrhenius activation energies extracted from relaxation data, should be treated with caution.
Greene, Patrick T. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Schofield, Samuel P. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Nourgaliev, Robert [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)
2016-06-21
A new mesh smoothing method designed to cluster mesh cells near a dynamically evolving interface is presented. The method is based on weighted condition number mesh relaxation with the weight function being computed from a level set representation of the interface. The weight function is expressed as a Taylor series based discontinuous Galerkin projection, which makes the computation of the derivatives of the weight function needed during the condition number optimization process a trivial matter. For cases when a level set is not available, a fast method for generating a low-order level set from discrete cell-centered elds, such as a volume fraction or index function, is provided. Results show that the low-order level set works equally well for the weight function as the actual level set. Meshes generated for a number of interface geometries are presented, including cases with multiple level sets. Dynamic cases for moving interfaces are presented to demonstrate the method's potential usefulness to arbitrary Lagrangian Eulerian (ALE) methods.
Superfluidity and relaxation dynamics of a laser-stirred two-dimensional Bose gas
Singh, Vijay Pal; Weitenberg, Christof; Dalibard, Jean; Mathey, Ludwig
2017-04-01
We investigate the superfluid behavior of a two-dimensional (2D) Bose gas of 87Rb atoms using classical field dynamics. In the experiment by R. Desbuquois et al. [Nat. Phys. 8, 645 (2012), 10.1038/nphys2378], a 2D quasicondensate in a trap is stirred with a blue-detuned laser beam along a circular path around the trap center. Here, we study this experiment from a theoretical perspective. The heating induced by stirring increases rapidly above a velocity vc, which we define as the critical velocity. We identify the superfluid, the crossover, and the thermal regime by a finite, a sharply decreasing, and a vanishing critical velocity, respectively. We demonstrate that the onset of heating occurs due to the creation of vortex-antivortex pairs. A direct comparison of our numerical results to the experimental ones shows a good agreement, if a systematic shift of the critical phase-space density is included. We relate this shift to the absence of thermal equilibrium between the condensate and the thermal wings, which were used in the experiment to extract the temperature. We expand on this observation by studying the full relaxation dynamics between the condensate and the thermal cloud.
T. Stensitzki
2016-07-01
Full Text Available We combined femtosecond (fs VIS pump–IR probe spectroscopy with fs VIS pump–supercontinuum probe spectroscopy to characterize the photoreaction of the hexacoordinated Al(tpfc-Br8(py2 in a comprehensive way. Upon fs excitation at ∼400 nm in the Soret band, the excitation energy relaxes with a time constant of (250 ± 80 fs to the S2 and S1 electronic excited states. This is evident from the rise time of the stimulated emission signal in the visible spectral range. On the same time scale, narrowing of broad infrared signals in the C=C stretching region around 1500 cm−1 is observed. Energy redistribution processes are visible in the vibrational and electronic dynamics with time constants between ∼2 ps and ∼20 ps. Triplet formation is detected with a time constant of (95 ± 3 ps. This is tracked by the complete loss of stimulated emission. Electronic transition of the emerging triplet absorption band overlaps considerably with the singlet excited state absorption. In contrast, two well separated vibrational marker bands for triplet formation were identified at 1477 cm−1 and at 1508 cm−1. These marker bands allow a precise identification of triplet dynamics in corrole systems.
Kozlowska, M; Kozlowska, Marzena; Kutner, Ryszard
2006-01-01
We analyse the dynamics of the Warsaw Stock Exchange index WIG at a daily time horizon before and after its well defined local maxima of the cusp-like shape decorated with oscillations. The rising and falling paths of the index peaks can be described by the Mittag-Leffler function superposed with various types of oscillations. The latter is a solution of our model of index dynamics defined by the nonhomogeneous fractional relaxation equation. This solution is a generalised analog of an exactly solvable model of viscoelastic materials. We found that the Warsaw Stock Exchange can be considered as an intermediate system lying between two complex ones, defined by short and long-time limits of the Mittag-Leffler function; these limits are given by the Kohlraush-Williams-Watts law for the initial times, and the power-law or the Nutting law for asymptotic time. Hence follows the corresponding short- and long-time power-law behaviour (different universality classes) of the time-derivative of the logarithm of WIG whic...
Schwartz, Benjamin Joel [Univ. of California, Berkeley, CA (United States)
1992-11-01
The fast excited state intramolecular proton transfer of 3-hydroxyflavone is measured and effects of external hydrogen-bonding interactions on the proton transfer are studied. The proton transfer takes place in ~240 fsec in nonpolar environments, but becomes faster than instrumental resolution of 110 fsec in methanol solution. The dynamics following photodissociation of CH_{2}I_{2} and other small molecules provide the first direct observations of geminate recombination. The recombination of many different photodissociating species occurs on a ~350 fsec time scale. Results show that recombination yields but not rates depend on the solvent environment and suggest that recombination kinetics are dominated by a single collision with surrounding solvent cage. Studies of sterically locked phenyl-substituted butadienes offer new insights into the electronic structure and isomerization behavior of conjugated polyenes. Data show no simple correlation between hinderance of specific large amplitude motions and signatures of isomerizative behavior such as viscosity dependent excited state lifetimes, implying that the isomerization does not provide a suitable for simple condensed phase reaction rate theories. The spectral dynamics of a photochromic spiropyran indicate that recombination, isomerization and vibrational relaxation all play important roles in photoreactivity of complex molecules. The interplay of these microscopic phenomena and their effect on macroscopic properties such as photochromism are discussed. All the results indicate that the initial steps of the photochromic reaction process occur extremely rapidly. Laser system and computer codes for data analysis are discussed.
Li, Yan; Yu, Jia-Wen; Liu, Zhong-Yi; Yang, En-Cui; Zhao, Xiao-Jun
2015-01-05
Three new homometallic lanthanide complexes with mixed carboxylate-modified rigid ligands, [Ln(μ3-OH)(na)(pyzc)]n (na(-) = 1-naphtholate, pyzc(-) = 2-pyrazinecarboxylate, Ln = Dy (1), Yb (2), and Gd (3)), were solvothermally synthesized, and their structures and magnetic as well as photophysical properties were completely investigated. Complexes 1-3 are crystallographically isostructural, exhibiting linear chains with four bidentate bridging μ-COO(-) moieties encapsulated cubic {Ln4(μ3-OH)4}(8+) clusters repeatedly extended by 4-fold chelating-bridging-pyzc(-) connectors. Magnetically, the former two complexes with highly anisotropic Dy(III) and weak anisotropic Yb(III) ions in the distorted NO7 triangular dodecahedron coordination environment display field-induced slow relaxation of magnetization. Fitting the dynamic magnetic data to the Arrhenius law gives energy barrier ΔE/kB = 39.6 K and pre-exponential factor τo = 1.52 × 10(-8) s for 1 and ΔE/kB = 14.1 K and τo = 2.13 × 10(-7) s for 2. By contrast, complex 3 with isotropic Gd(III) ion and weak intracluster antiferromagnetic coupling shows a significant cryogenic magnetocaloric effect, with a maximum -ΔSm value of 30.0 J kg(-1) K(-1) at 2.5 K and 70 kOe. Additionally, the chromophoric na(-) and pyzc(-) ligands can serve as antenna groups, selectively sensitizing the Dy(III)- and Yb(III)-based luminescence of 1 and 2 in the UV-visible region by an intramolecular energy transfer process. Thus, complexes 1-3, incorporating field-induced slow magnetic magnetization and interesting luminescence together, can be used as composite magneto-optical materials. More importantly, these interesting results further demonstrate that the mixed-ligand system with rigid carboxylate-functionalized chromophores can be excellent candidates for the preparations of new bifunctional magneto-optical materials.
Domain wall dynamics of magnetically bistable microwires
Ipatov M.
2012-06-01
Full Text Available We studied domain wall propagation of magnetically-bistable Fe- Co-rich microwires paying attention on effect of applied and internal stresses. We measured hysteresis loops and domain wall propagation in various magnetic Fe- Co-rich amorphous microwires with metallic nucleus diameters (from 12 □m till 22 □m using Sixtus Tonks-like experiments. Application of tensile stresses results in decreasing of domain wall velocity. We discussed magnetoelastic contribution in dynamics of domain wall propagation. We observed, that microwires with different geometries exhibit v(H dependences with different slopes. Application of stresses resulted in decrease of DW velocity, v, and DW mobility S. Quite fast DW propagation (v till 2500 m/s at H about 30 A/m has been observed in low magnetostrictive magnetically bistable Co56Fe8Ni10Si110B16 microwires. Consequently, we can assume that generally magnetoelastic energy affects DW dynamics: decreasing magnetoelastic energy, Kme, DW velocity increases.
Huang, Chongyang; Zhou, Qi; Gao, Shan; Bao, Qingjia; Chen, Fang; Liu, Chaoyang
2016-01-20
Different ginger cultivars may contain different nutritional and medicinal values. In this study, a time-domain nuclear magnetic resonance method was employed to study water dynamics in different ginger cultivars. Significant differences in transverse relaxation time T2 values assigned to the distribution of water in different parts of the plant were observed between Henan ginger and four other ginger cultivars. Ion concentration and metabolic analysis showed similar differences in Mn ion concentrations and organic solutes among the different ginger cultivars, respectively. On the basis of Pearson's correlation analysis, many organic solutes and 6-gingerol, the main active substance of ginger, exhibited significant correlations with water distribution as determined by NMR T2 relaxation, suggesting that the organic solute differences may impact water distribution. Our work demonstrates that low-field NMR relaxometry provides useful information about water dynamics in different ginger cultivars as affected by the presence of different organic solutes.
Yacyshyn, Alexandra F; Nettleton, Jane; Power, Geoffrey A; Jakobi, Jennifer M; McNeil, Chris J
2017-09-01
Transcranial magnetic stimulation (TMS) of the motor cortex during a maximal voluntary contraction (MVC) permits functionally relevant measurements of muscle group relaxation rate (i.e., when muscles are actively contracting under voluntary control). This study's purpose was twofold: (1) to explore the impact of muscle length on TMS-induced plantar flexor relaxation rate; and (2) to incorporate ultrasonography to measure relaxation-induced lengthening of medial gastrocnemius (MG) fascicles and displacement of the muscle-tendon junction (MTJ). Eleven males (24.8 ± 7.0 years) performed 21 brief isometric plantar flexor MVCs. Trials were block-randomized every three MVCs among 20° dorsiflexion (DF), a neutral ankle position, and 30° plantar flexion (PF). During each MVC, TMS was delivered and ultrasound video recordings captured MG fascicles or MTJ length changes. Peak relaxation rate was calculated as the steepest slope of the TMS-induced drop in plantar flexor torque or the rate of length change for MG fascicles and MTJ Torque relaxation rate was slower for PF (-804 ± 162 Nm·s(-1)) than neutral and DF (-1896 ± 298 and -2008 ± 692 Nm·s(-1), respectively). Similarly, MG fascicle relaxation rate was slower for PF (-2.80 ± 1.10 cm·s(-1)) than neutral and DF (-5.35 ± 1.10 and -4.81 ± 1.87 cm·s(-1), respectively). MTJ displacement rate showed a similar trend (P = 0.06), with 3.89 ± 1.93 cm·s(-1) for PF compared to rates of 6.87 ± 1.55 and 6.36 ± 2.97 cm·s(-1) for neutral and DF, respectively. These findings indicate muscle length affects the torque relaxation rate recorded after TMS during an MVC Comparable results were obtained from muscle fascicles, indicating ultrasound imaging is suitable for measuring evoked contractile properties during voluntary contraction. © 2017 The Authors. Physiological Reports published by Wiley Periodicals, Inc. on behalf of The Physiological Society and the American Physiological Society.
Free Magnetic Energy in Solar Active Regions above the Minimum-Energy Relaxed State
Regnier, Stephane; Priest, Eric
2007-01-01
To understand the physics of solar flares, including the local reorganisation of the magnetic field and the acceleration of energetic particles, we have first to estimate the free magnetic energy available for such phenomena, which can be converted into kinetic and thermal energy. The free magnetic energy is the excess energy of a magnetic configuration compared to the minimum-energy state, which is a linear force-free field if the magnetic helicity of the configuration is conserved. We inves...
Cooking effects on water distribution in potatoes using nuclear magnetic resonance relaxation.
Mortensen, Margit; Thybo, Anette K; Bertram, Hanne C; Andersen, Henrik J; Engelsen, Søren B
2005-07-27
Continuous low-field (LF) (1)H NMR relaxometry was used to monitor the structural changes during cooking of potatoes with two different dry matter (DM) contents. A principal component analysis of the relaxation decay curves revealed major events related to water mobility during cooking, which occur at 53 and 60 degrees C for potatoes with medium and low DM contents, respectively. Exponential analysis of the relaxation decays reveals two major water populations in the potato: a slow-relaxing (assigned to water in cytoplasm and extracellular cavities) water component, T(22) ( approximately 350-550 ms), and a fast-relaxing component (primarily assigned to water associated with starch and cell walls), T(21) ( approximately 45-65 ms). Significant DM dependent shifts in both the T(21) and T(22) relaxation time constants were observed during cooking, indicating that starch gelatinizes between 53 and 70 degrees C with water exchanging with the hydroxyls of starch (transition in T(21)) and cells start to disrupt with an increase in diffusion volumes at approximately 60 degrees C (transition in T(22)). The study reveals that continuous LF NMR measurement is an excellent and highly sensitive method to study changes in water mobility and water populations during the cooking of potatoes.
Coupled spin, elastic and charge dynamics in magnetic nanostructures
Kamra, A.
2015-01-01
In this Thesis, I address the interaction of magnetic degrees of freedom with charge current and elastic dynamics in hybrid systems composed of magnetic and non-magnetic materials. The objective, invariably, is to control and study spin dynamics using charge and elastic degrees of freedom. In certai
Study of electronic structure and magnetism at the relaxed SrTiO3/LaAlO3 interface
Ghosh, Soham; Manousakis, Efstratios
2013-03-01
The SrTiO3/LaAlO3 interface has been found experimentally to be metallic and magnetic, with bandstructure calculations linking both phenomena to polar catastrophe and surface oxygen vacancies. In this work, we use LDA+U to study the properties of this interface, allowing the ionic structure to be fully relaxed, and investigate the 2-dimensional nature of the electron gas formed at the junction. We present an effort to understand the role of electron-electron correlation on the interfacial collective phenomena, by constructing extended Hubbard-like models based on bandstructure calculation.
Shu, Chunying; Corwin, Frank D.; Zhang, Jianfei; Chen, Zhijian; Reid, Jonathan E.; Sun, Minghao; Xu, Wei; Sim, Jae Hyun; Wang, Chunru; Fatouros, Panos P.; Alan R Esker; Gibson, Harry W.; Dorn, Harry C.
2009-01-01
A new magnetic resonance imaging (MRI) contrast agent based on the trimetallic nitride templated (TNT) metallofullerene, Gd3N@C80, was synthesized by a facile method in high yield. The observed longitudinal and transverse relaxivities, r1 and r2, for water hydrogens in the presence of the water-soluble gadofullerene 2, Gd3N@C80(OH)~26(CH2CH2COOM)~16 (M = Na or H), are 207 and 282 mM-1s-1 (per C80 cage) at 2.4 T, respectively; these values are 50 times larger than those of Gd3+ poly(aminocarbo...
Nath, R.; El Goresy, T.; Geil, B.; Zimmermann, H.; Böhmer, R.
2006-08-01
Supercooled liquid and glassy acetylsalicylic acid was studied using dielectric spectroscopy and deuteron relaxometry in a wide temperature range. The supercooled liquid is characterized by major deviations from thermally activated behavior. In the glass the secondary relaxation exhibits the typical features of a Johari-Goldstein process. Via measurements of spin-lattice relaxation times the selectively deuterated methyl group was used as a sensitive probe of its local environments. There is a large difference in the mean activation energy in the glass with respect to that in crystalline acetylsalicylic acid. This can be understood by taking into account the broad energy barrier distribution in the glass.
Nerkararyan, Khachatur V; Bozhevolnyi, Sergey I
2015-01-01
We investigate the relaxation dynamics of a quantum dipole emitter (QDE), e.g., a molecule or quantum dot, located near a metal nanoparticle (MNP) exhibiting a dipolar localized surface plasmon (LSP) resonance at the frequency of the QDE radiative transition. A generic three-level QDE, which is pumped with an external laser pulse and thereby brought into an optically active excited state, is considered to be weakly coupled to the resonant LSP described by a coherent state. It is shown that, under the condition of the QDE-MNP characteristic relaxation time being much shorter than that of the QDE in free space but much longer than the LSP lifetime, the QDE relaxation dynamics can be described analytically and feature, in general, non-exponential decay with complicated transient behaviour. The main physical consequence of this relaxation process is that the emission, being largely determined by the MNP, comes out with a substantial delay. It is also shown that energy dissipation in the QDE-MNP system is relatively weak with the probability of the photon emission being ∼0.75, a number which, rather surprisingly, does not explicitly depend on the metal absorption characteristics. A large number of QDE-MNP system parameters in our analytical description open new possibilities for controlling quantum emitter dynamics.
Schwartz, Benjamin Joel
Femtosecond and picosecond transient absorption spectroscopy are used to probe several fundamental aspects of chemical reactivity in the condensed phase including proton transfer, germinate recombination, isomerization and vibrational relaxation. The fast excited state intramolecular proton transfer of 3-hydroxyflavone is measured for the first time, and the effects of external hydrogen-bonding interactions on the proton transfer are studied in detail. The proton transfer takes place in ~240 fsec in non-polar environments, but becomes faster than the instrumental resolution of 110 fsec in methanol solutions. A simple model is proposed to explain these results. The dynamics following photodissociation of CH _2I_2 and other small molecules provide the first direct observations of germinate recombination. The recombination of many different photodissociating species occurs on a ~350 fsec time scale. Results also show that recombination yields but not rates depend on the molecular details of the solvent environment and suggest that recombination kinetics are dominated by a single collision with the surrounding solvent cage. Studies of sterically locked phenyl-substituted butadienes offer new insights into the electronic structure and isomerization behavior of conjugated polyenes. The data show no simple correlation between the hinderance of specific large amplitude motions and signatures of isomerizative behavior such as viscosity dependent excited state lifetimes. This strongly implies that the isomerization of these systems does not provide a suitable testing ground for simple condensed phase reaction rate theories. The spectral dynamics of a photochromic spiropyran indicate that recombination, isomerization and vibrational relaxation all play important roles in the photoreactivity of complex molecules. The interplay of these microscopic phenomena and their effect on macroscopic properties such as photochromism are discussed. All the results indicate that the initial
Slow spin relaxation induced by magnetic field in [NdCo(bpdo)(H2O)4(CN)6]⋅3H2O.
Vrábel, P; Orendáč, M; Orendáčová, A; Čižmár, E; Tarasenko, R; Zvyagin, S; Wosnitza, J; Prokleška, J; Sechovský, V; Pavlík, V; Gao, S
2013-05-01
We report on a comprehensive investigation of the magnetic properties of [NdCo(bpdo)(H2O)4(CN)6]⋅3H2O (bpdo=4, 4'-bipyridine-N,N'-dioxide) by use of electron paramagnetic resonance, magnetization, specific heat and susceptibility measurements. The studied material was identified as a magnet with an effective spin S = 1/2 and a weak exchange interaction J/kB = 25 mK. The ac susceptibility studies conducted at audio frequencies and at temperatures from 1.8 to 9 K revealed that the application of a static magnetic field induces a slow spin relaxation. It is suggested that the relaxation in the magnetic field appears due to an Orbach-like process between the two lowest doublet energy states of the magnetic Nd(3+) ion. The appearance of the slow relaxation in a magnetic field cannot be associated with a resonant phonon trapping. The obtained results suggest that the relaxation is influenced by nuclear spin driven quantum tunnelling which is suppressed by external magnetic field.
Critical dynamics of an interacting magnetic nanoparticle system
Hansen, Mikkel Fougt; Jonsson, P.E.; Nordblad, P.
2002-01-01
Effects of dipole-dipole interactions on the magnetic relaxation have been investigated for three Fe-C nanoparticle samples with volume concentrations of 0.06, 5 and 17 vol%. While both the 5 and 17 vol% samples exhibit collective behaviour due to dipolar interactions, only the 17 vol% sample...
Järvinen, J.; Ahokas, J.; Sheludyakov, S.; Vainio, O.; Lehtonen, L.; Vasiliev, S.; Zvezdov, D.; Fujii, Y.; Mitsudo, S.; Mizusaki, T.; Gwak, M.; Lee, SangGap; Lee, Soonchil; Vlasenko, L.
2014-12-01
Efficient manipulation of nuclear spins is important for utilizing them as qubits for quantum computing. In this work we report record high polarizations of 31P and 29Si nuclear spins in P-doped silicon in a strong magnetic field (4.6 T) and at temperatures below 1 K. We reached 31P nuclear polarization values exceeding 98 % after 20 min of pumping the high-field electron spin resonance (ESR) line with a very small microwave power of 0.4 μ W . We evaluate that the ratio of the hyperfine-state populations increases by three orders of magnitude after 2 hours of pumping, and an extremely pure nuclear spin state can be created, with less than 0.01 ppb impurities. A negative dynamic nuclear polarization has been observed by pumping the low-field ESR line of 31P followed by the flip-flip cross relaxation, the transition which is fully forbidden for isolated donors. We estimate that while pumping the ESR transitions of 31P also the nuclei of 29Si get polarized, and polarization exceeding 60 % has been obtained. We performed measurements of relaxation rates of flip-flop and flip-flip transitions which turned out to be nearly temperature independent. Temperature dependence of the 31P nuclear relaxation was studied down to 0.75 K, below which the relaxation time became too long to be measured. We found that the polarization evolution under pumping and during relaxation deviates substantially from a simple exponential function of time. We suggest that the nonexponential polarization dynamics of 31P donors is mediated by the orientation of 29Si nuclei, which affect the transition probabilities of the forbidden cross-relaxation processes.
Kodama, Kazuto
2015-02-01
This study proposes a new method for measuring transient magnetization of natural samples induced by a pulsed field with duration of 11 ms using a pulse magnetizer. An experimental system was constructed, consisting of a pair of differential sensing coils connected with a high-speed digital oscilloscope for data acquisition. The data were transferred to a computer to obtain an initial magnetization curve and a descending branch of a hysteresis loop in a rapidly changing positive field. This system was tested with synthetic samples (permalloy ribbon, aluminum plate, and nickel powder) as well as two volcanic rock samples. Results from the synthetic samples showed considerable differences from those measured by a quasi-static method using a vibrating sample magnetometer (VSM). These differences were principally due to the time-dependent magnetic properties or to electromagnetic effects, such as magnetic viscosity, eddy current loss, or magnetic relaxation. Results from the natural samples showed that the transient magnetization-field curves were largely comparable to the corresponding portions of the hysteresis loops. However, the relative magnetization (scaled to the saturation magnetization) at the end of a pulse was greater than that measured by a VSM. This discrepancy, together with the occurrence of rapid exponential decay after a pulse, indicates magnetic relaxations that could be interpreted in terms of domain wall displacement. These results suggest that with further developments, the proposed technique can become a useful tool for characterizing magnetic particles contained in a variety of natural materials.
Magnetization dynamics of imprinted non-collinear spin textures
Streubel, Robert, E-mail: r.streubel@ifw-dresden.de; Kopte, Martin; Makarov, Denys, E-mail: d.makarov@ifw-dresden.de [Institute for Integrative Nanosciences, IFW Dresden, 01069 Dresden (Germany); Fischer, Peter [Center for X-Ray Optics, Lawrence Berkeley National Laboratory, Berkeley, California 94720 (United States); Physics Department, UC Santa Cruz, Santa Cruz, California 95064 (United States); Schmidt, Oliver G. [Institute for Integrative Nanosciences, IFW Dresden, 01069 Dresden (Germany); Material Systems for Nanoelectronics, Chemnitz University of Technology, 09107 Chemnitz (Germany)
2015-09-14
We study the magnetization dynamics of non-collinear spin textures realized via imprint of the magnetic vortex state in soft permalloy into magnetically hard out-of-plane magnetized Co/Pd nanopatterned heterostructures. Tuning the interlayer exchange coupling between soft- and hard-magnetic subsystems provides means to tailor the magnetic state in the Co/Pd stack from being vortex- to donut-like with different core sizes. While the imprinted vortex spin texture leads to the dynamics similar to the one observed for vortices in permalloy disks, the donut-like state causes the appearance of two gyrofrequencies characteristic of the early and later stages of the magnetization dynamics. The dynamics are described using the Thiele equation supported by the full scale micromagnetic simulations by taking into account an enlarged core size of the donut states compared to magnetic vortices.
Horke, Daniel A; Roberts, Gareth M; Verlet, Jan R R
2011-08-04
The spectroscopy and ultrafast relaxation dynamics of excited states of the radical anion of a representative charge-transfer acceptor molecule, 2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane, have been studied in the gas phase using time-resolved photoelectron spectroscopy. The photoelectron spectra reveal that at least two anion excited states are bound. Time-resolved studies show that both excited states are very short-lived and internally convert to the anion ground state, with the lower energy state relaxing within 200 fs and a near-threshold valence-excited state relaxing on a 60 fs time scale. These excited states, and in particular the valence-excited state, present efficient pathways for electron-transfer reactions in the highly exergonic inverted region which commonly displays rates exceeding predictions from electron-transfer theory.
A C Ribeiro; P J Sebastiao; C Cruz
2003-08-01
We present in this work a review concerning wide frequency range 1 proton NMR relaxation studies performed in compounds exhibiting columnar mesophases, namely the Colho mesophase in the case of a liquid crystal of discotic molecules and the h mesophase in the case of a liquid crystal of biforked molecules. These NMR relaxation studies were performed combining conventional and fast ﬁeld cycling NMR techniques in a frequency range between 100 Hz and 300 MHz. The possibility of probing such a large frequency range has provided a way to effectively distinguish the inﬂuence, on the 1 relaxation proﬁles, of the different molecular movements observed in this type of mesophases. In addition, we present a comparison between the molecular dynamics in columnar (h) and lamellar (SmC) mesophases exhibited by the same biforked compound.
Chen, Enn-Ling; Kim, Raymond J.
2010-01-01
Background Image contrast in clinical MRI is often determined by differences in tissue water proton relaxation behavior. However, many aspects of water proton relaxation in complex biological media, such as protein solutions and tissue are not well understood, perhaps due to the limited empirical data. Principal Findings Water proton T1, T2, and T1ρ of protein solutions and tissue were measured systematically under multiple conditions. Crosslinking or aggregation of protein decreased T2 and T1ρ, but did not change high-field T1. T1ρ dispersion profiles were similar for crosslinked protein solutions, myocardial tissue, and cartilage, and exhibited power law behavior with T1ρ(0) values that closely approximated T2. The T1ρ dispersion of mobile protein solutions was flat above 5 kHz, but showed a steep curve below 5 kHz that was sensitive to changes in pH. The T1ρ dispersion of crosslinked BSA and cartilage in DMSO solvent closely resembled that of water solvent above 5 kHz but showed decreased dispersion below 5 kHz. Conclusions Proton exchange is a minor pathway for tissue T1 and T1ρ relaxation above 5 kHz. Potential models for relaxation are discussed, however the same molecular mechanism appears to be responsible across 5 decades of frequencies from T1ρ to T1. PMID:20052404
Grunin, Yu. B.; Grunin, L. Yu.; Masas, D. S.; Talantsev, V. I.; Sheveleva, N. N.
2016-11-01
The possibility of determining the thermodynamic parameters that characterize the sorption properties of cellulose and the state of water associated with its fibers is demonstrated using modern concepts of the structure of this vegetable polymer and methods based on theories of adsorption and NMR relaxation in heterogeneous systems.
Xiong, Gang; Qin, Xiang-Yang; Shi, Peng-Fei; Hou, Yin-Ling; Cui, Jian-Zhong; Zhao, Bin
2014-04-25
Two unique heptanuclear clusters Ln@Zn6 (Ln = Dy (1), Er (2)) were structurally and magnetically characterized. Each Dy(3+)/Er(3+) is located in a nona-coordinate D(3h) coordination environment, and is encapsulated in a diamagnetic Zn6 cage. Compound 1 exhibits single-ion magnetic behavior, and is the first example of a single-ion magnet (SIM) constructed through embedding one magnetic anisotropic metal ion into a diamagnetic cage.
Govind, Chinju; Karunakaran, Venugopal
2017-04-13
Hemin is a unique model compound of heme proteins carrying out variable biological functions. Here, the excited state relaxation dynamics of heme model compounds in the ferric form are systematically investigated by changing the axial ligand (Cl/Br), the peripheral substituent (vinyl/ethyl-meso), and the solvent (methanol/DMSO) using femtosecond pump-probe spectroscopy upon excitation at 380 nm. The relaxation time constants of these model compounds are obtained by global analysis. Excited state deactivation pathway of the model compounds comprising the decay of the porphyrin excited state (S*) to ligand to metal charge transfer state (LMCT, τ1), back electron transfer from metal to ligand (MLCT, τ2), and relaxation to the ground state through different electronic spin states of iron (τ3 and τ4) are proposed along with the vibrational cooling processes. This is based on the excited state absorption spectral evolution, similarities between the transient absorption spectra of the ferric form and steady state absorption spectra of the low-spin ferrous form, and the data analysis. The observation of an increase of all the relaxation time constants in DMSO compared to the methanol reflects the stabilization of intermediate states involved in the electronic relaxation. The transient absorption spectra of met-myoglobin are also measured for comparison. Thus, the transient absorption spectra of these model compounds reveal the involvement of multiple iron spin states in the electronic relaxation dynamics, which could be an alternative pathway to the ground state beside the vibrational cooling processes and associated with the inherent features of the heme b type.